Model name: model_name=EAM_Dynamo_AcklandTichyVitek_1987v2_Ni__MO_769632475533_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.524220451712608
cohesive_energy=4.459348122777618
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.94996111594238e-19, 3.49620576364944e-19, 4.4303388283368e-19, 5.01918680663082e-19, 5.3844350138838e-19, 5.61745558353276e-19, 5.786885762578259e-19, 5.92297464587022e-19, 6.04831292394804e-19, 6.1744683121092e-19, 6.29955024192558e-19, 6.42030629483016e-19, 6.534909989460179e-19, 6.64219173687282e-19, 6.740405164537019e-19, 6.828284552911919e-19, 6.905189031343919e-19, 6.97094236040328e-19, 7.025624648921699e-19, 7.0694441798616e-19, 7.102785475615139e-19, 7.12604908034082e-19, 7.139667581729819e-19, 7.144105611005999e-19, 7.138770362814779e-19, 7.119287894945339e-19, 7.079858327982599e-19, 7.01589943675332e-19, 6.924703542746039e-19, 6.80337070625322e-19, 6.64858442164248e-19, 6.456531508524899e-19, 6.222805981156979e-19, 5.942184743711879e-19, 5.60835522025164e-19, 5.2138833111945e-19, 4.748418955484819e-19, 4.1938415353920593e-19, 3.52650292379838e-19, 2.71291762905318e-19, 1.7088175107590398e-19, 4.7145489414420596e-20, -1.052376904629828e-19, -2.99139194980872e-19, -5.623768159470719e-19, -9.31229920626552e-19, -1.464963022710972e-18, -2.24594722730754e-18, -3.3994983820211996e-18, -5.1675643847055595e-18, -8.07205427388612e-18, -1.319988467806848e-17, -2.28986288884548e-17, -4.3643932380813594e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.018095180056715114
Energy: 0.01870265140784755
Energy: 0.018932107634860956
Energy: 0.018422256894939967
Energy: 0.47925284022305487
Energy: 0.018496323574576683
Energy: 0.018702651408507492
Energy: 0.1686654429167707
Energy: 0.16866761570006028
Energy: 0.16886417408165608
Energy: 0.16878769697059473
Energy: 0.1690429324278314
Energy: 0.018932107633247753
Energy: 0.16866761570006028
Energy: 0.16865370239277214
Energy: 0.01886241389468023
Energy: 0.16854315929417552
Energy: 0.16872197308751638
Energy: 0.01842225689655317
Energy: 0.16886417408198603
Energy: 0.01886241389468023
Energy: 0.01846476704137288
Energy: 0.16859401811467536
Energy: 0.018617179695198834
Energy: 0.47925284022239495
Energy: 0.16878769697026477
Energy: 0.1685431592945055
Energy: 0.16859401811628855
Energy: 0.1684879800105319
Energy: 0.16858088749120773
Energy: 0.018496323575236628
Energy: 0.16904293242687815
Energy: 0.16872197308689307
Energy: 0.01861717969809526
Energy: 0.16858088749120773
Energy: 0.018740029205511197

minimum gb energy = 0.018095180056715114 eV
minimum distance =  2.48771310808048 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.61222008523375
Energy: 1.1238741260977243
Energy: 1.2421598424635274
Energy: 1.6133642677169944
Energy: 1.084796191311692
Energy: 1.1646354585591954
Energy: 1.4475818129270783
Energy: 1.1001059135855988
Energy: 1.10648410641973
Energy: 1.3599093082952265
Energy: 1.1007224890716247
Energy: 1.084302935749998
Energy: 1.4166980363329056
Energy: 1.1175444011899087
Energy: 1.1009222083451662
Energy: 1.3039263339652647
Energy: 1.1178680651502053
Energy: 1.0994955675109377
Energy: 1.6906197249232016
Energy: 1.4248691575498083
Energy: 1.321576444113687
Energy: 1.1474997156989346
Energy: 1.4218940816407097
Energy: 1.32040518870305
Energy: 1.4239080367820445
Energy: 1.1389806200150447
Energy: 1.2225184513263003
Energy: 1.3630765302218193
Energy: 1.144939141596665
Energy: 1.2210905126406473
Energy: 1.4202187080567459
Energy: 1.2145245649123264
Energy: 1.2146045745117267
Energy: 1.3068290264355544
Energy: 1.1976480078046188
Energy: 1.2153587551666971
Energy: 1.37012002460937
Energy: 1.2196217509461533
Energy: 1.3096186372539311
Energy: 1.2821129920101757
Energy: 1.3398951269630095
Energy: 1.2696748483686615
Energy: 1.3506136532001052
Energy: 1.2954357168130386
Energy: 1.2931161874360564
Energy: 1.3375644284260828
Energy: 1.3056572465563598
Energy: 1.303553732353263
Energy: 1.1806215902241677
Energy: 1.2554126247225113
Energy: 1.2189247079645438
Energy: 1.1798372810396593
Energy: 1.25520439502304
Energy: 1.219050420821588
Energy: 1.2881753960057007
Energy: 1.264189234163589
Energy: 1.22629245584245
Energy: 1.2607766224562538
Energy: 1.2578506073066693
Energy: 1.2223039084905891
Energy: 1.1241516558458897
Energy: 1.3171529870951868
Energy: 1.2687019490629532
Energy: 1.1243964861094786
Energy: 1.2639687307779046
Energy: 1.2583023318482889
Energy: 1.1181325095407364
Energy: 1.1459749924300324
Energy: 1.1007893985173152
Energy: 1.1180627013871889
Energy: 1.2400467590760578
Energy: 1.099381828298501
Energy: 1.098397342428493
Energy: 1.2066057076705439
Energy: 1.0994921695803486
Energy: 1.094115257538853
Energy: 1.313665832068995
Energy: 1.0850214294760852
Energy: 1.2289469030346587
Energy: 1.205730115510432
Energy: 1.2270534211647475
Energy: 1.1598587897127333
Energy: 1.2073277888624834
Energy: 1.2108677692923329
Energy: 1.1417033895078768
Energy: 1.2480695082418574
Energy: 1.1426709402214477
Energy: 1.1418263178467194
Energy: 1.2596807154483156
Energy: 1.141457424176554
Energy: 1.1543253324139549
Energy: 1.2510845476063086
Energy: 1.1711738020994227
Energy: 1.1545665746138842
Energy: 1.2484603994389638
Energy: 1.1739776480240716
Energy: 1.3866979124167107
Energy: 1.3176189760058183
Energy: 1.3199536821541007
Energy: 1.3890436514306335
Energy: 1.3166547913828606
Energy: 1.2235889850045347
Energy: 1.3294666777474595
Energy: 1.2723016373461973
Energy: 1.2627684055541477
Energy: 1.270183361200003
Energy: 1.3212630352238417
Energy: 1.2956376283836868
Energy: 1.3085470813805504
Energy: 1.2457785987390257
Energy: 1.243983269835165
Energy: 1.2518676114548097
Energy: 1.2559837095650308
Energy: 1.2434116460193705
Energy: 1.3743792365304364
Energy: 1.212004659478451
Energy: 1.2563347943393501
Energy: 1.3255571290332733
Energy: 1.2091374805511004
Energy: 1.2529498780043253
Energy: 1.616086777784679
Energy: 1.1577244051710505
Energy: 1.1919146975425263
Energy: 1.1876185337583947
Energy: 1.388563783248114
Energy: 1.192151686440936
Energy: 1.38438952806765
Energy: 1.1584494334958435
Energy: 1.1580526464991943
Energy: 1.2851947241487585
Energy: 1.1357305254660846
Energy: 1.1577949648500563
Energy: 1.4474507130266583
Energy: 1.101302428661089
Energy: 1.1626168904441907
Energy: 1.4110162003847584
Energy: 1.1591342566322453
Energy: 1.1423776488343012

minimum gb energy = 1.084302935749998 eV
minimum distance =  2.28422899421669 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.9925815841928558
Energy: 1.2661676193045428
Energy: 1.239682152663668
Energy: 1.130481708257836
Energy: 1.2241395845926863
Energy: 1.2665480267114613
Energy: 1.390037286059972
Energy: 1.1320129013118352
Energy: 1.1354137102912647
Energy: 1.3480427412262632
Energy: 1.1349527634907284
Energy: 1.1180184168396665
Energy: 1.4214329147169564
Energy: 1.1363910463828208
Energy: 1.1599167345713983
Energy: 1.3308241784784431
Energy: 1.1361505077390712
Energy: 1.136384321538407
Energy: 1.6399067605717836
Energy: 1.348679579497111
Energy: 1.4181635319509782
Energy: 1.2002555900028482
Energy: 1.2015090268333408
Energy: 1.2693423151757197
Energy: 1.4201538592614178
Energy: 1.2174987679474156
Energy: 1.2176013434930708
Energy: 1.3556055505649662
Energy: 1.2341099492005676
Energy: 1.2568462668510736
Energy: 1.4313145096601845
Energy: 1.2048546273398117
Energy: 1.2862937386024627
Energy: 1.3598378446649382
Energy: 1.1838777893121977
Energy: 1.2906732055264036
Energy: 1.3871808208636631
Energy: 1.4220203580639652
Energy: 1.4302925408670744
Energy: 1.3891677730205199
Energy: 1.3983614405139662
Energy: 1.3455900438800736
Energy: 1.3925779190530956
Energy: 1.2776001885066697
Energy: 1.2785656389259934
Energy: 1.3295920104516594
Energy: 1.3120949307154324
Energy: 1.2776994272953113
Energy: 1.2651919963105638
Energy: 1.270443996511044
Energy: 1.2860367037455356
Energy: 1.2647858393247582
Energy: 1.3023010081763045
Energy: 1.285286986614559
Energy: 1.34371548035011
Energy: 1.292590252693571
Energy: 1.2761328630182742
Energy: 1.3451960231282711
Energy: 1.3936099551407968
Energy: 1.2920976534458306
Energy: 1.3515330360141724
Energy: 1.1178036129467293
Energy: 1.1187758445453708
Energy: 1.2539484349278558
Energy: 1.1027288771839987
Energy: 1.2223651616924576
Energy: 1.256432191702672
Energy: 1.1302648725426792
Energy: 1.1955431309315436
Energy: 1.2569227943278818
Energy: 1.3213898030727331
Energy: 1.2006901530483212
Energy: 1.1881868613470012
Energy: 1.3024317732697908
Energy: 1.1988753830357486
Energy: 1.18819458085116
Energy: 1.3444968914556557
Energy: 1.1961415880451265
Energy: 1.29790007297232
Energy: 1.2619017177492726
Energy: 1.265430088429747
Energy: 1.2932316348594262
Energy: 1.2197315661411536
Energy: 1.2655549919420954
Energy: 1.258142389127965
Energy: 1.2420045620558573
Energy: 1.2683041877919623
Energy: 1.258788009598143
Energy: 1.3890380133976932
Energy: 1.2328227876022906
Energy: 1.3327832676709734
Energy: 1.3083418076561903
Energy: 1.2924188180273197
Energy: 1.295730332502614
Energy: 1.2942404808931578
Energy: 1.2852124625990926
Energy: 1.4366888343977964
Energy: 1.349516878242262
Energy: 1.3096070261385133
Energy: 1.4025871875912952
Energy: 1.331071559841772
Energy: 1.4152558161704374
Energy: 1.34387115944294
Energy: 1.3276824897163846
Energy: 1.3225156816927635
Energy: 1.3124266985012758
Energy: 1.4103783839076325
Energy: 1.285571096606866
Energy: 1.3736764799836176
Energy: 1.2625042692098218
Energy: 1.261952664187469
Energy: 1.2895975942554248
Energy: 1.2478788340440077
Energy: 1.2679897967701705
Energy: 1.4937397459629342
Energy: 1.2831241967947151
Energy: 1.2833047061744811
Energy: 1.4066300163786132
Energy: 1.2810541600210663
Energy: 1.2857205530698053
Energy: 1.9625936092745482
Energy: 1.3493323705429718
Energy: 1.3014571212043367
Energy: 1.1899679536980572
Energy: 1.348621935058486
Energy: 1.316804008254426
Energy: 1.4018766005573502
Energy: 1.2336094455762399
Energy: 1.2335145546985369
Energy: 1.4022485768934938
Energy: 1.2334357853439435
Energy: 1.1875197289885284
Energy: 1.4645311579065021
Energy: 1.1789538046154566
Energy: 1.1789348957510801
Energy: 1.3932758050991076
Energy: 1.17827596643301
Energy: 1.1783491188538209
Energy: 1.6431779016097685
Energy: 1.2188389441028162
Energy: 1.2092240481842194
Energy: 1.6438872790743306
Energy: 1.2192482862366636
Energy: 1.257604135216993
Energy: 1.4505852853073167
Energy: 1.1857833669762654
Energy: 1.1855158255927098
Energy: 1.4355969763125545
Energy: 1.2501231873090684
Energy: 1.2494310908367041
Energy: 1.412710740749911
Energy: 1.2947523610910412
Energy: 1.291108395894333
Energy: 1.3653820239811445
Energy: 1.2958847281940524
Energy: 1.290191442176932
Energy: 1.660550734422854
Energy: 1.4174084699900589
Energy: 1.41756791836809
Energy: 1.27395411297449
Energy: 1.4185284091351393
Energy: 1.4040768353532205
Energy: 1.394173222163679
Energy: 1.2807802432327933
Energy: 1.27918620170968
Energy: 1.3930257143530533
Energy: 1.2782189788669684
Energy: 1.3321140062227266
Energy: 1.2698301186271774
Energy: 1.2700236315188769
Energy: 1.2703922590596297
Energy: 1.2699768796895168
Energy: 1.2992183474321815
Energy: 1.2953833451704535
Energy: 1.2744158004336748
Energy: 1.2987550549586526
Energy: 1.29923740375727
Energy: 1.2726782225479274
Energy: 1.3910410879374913
Energy: 1.299805046296952
Energy: 1.3984100792074832
Energy: 1.1196827034855747
Energy: 1.1189288785192268
Energy: 1.3963635028105794
Energy: 1.120096601362235
Energy: 1.2708352774126874
Energy: 1.237292722803005
Energy: 1.2094370544769155
Energy: 1.0948367616607395
Energy: 1.241733284308514
Energy: 1.2624208956755154
Energy: 1.207746798902532
Energy: 1.1873324817094526
Energy: 1.3053900583478077
Energy: 1.1956280162947335
Energy: 1.189643215538614
Energy: 1.369423741962292
Energy: 1.1945385992573005
Energy: 1.1980241346345546
Energy: 1.2686303565376729
Energy: 1.2693974768283094
Energy: 1.1987540102635217
Energy: 1.1981045403367532
Energy: 1.2694688004195285
Energy: 1.2544639507313082
Energy: 1.3316928275510231
Energy: 1.2687526891221022
Energy: 1.2101752514808763
Energy: 1.3678600863883665
Energy: 1.225233488382839
Energy: 1.2910249711513762
Energy: 1.2329989623852162
Energy: 1.254886193227197
Energy: 1.2854473433461815
Energy: 1.4237803735180101
Energy: 1.2538099929322524
Energy: 1.3265056075042891
Energy: 1.2949786905620408
Energy: 1.256101222586179
Energy: 1.2241903863072143
Energy: 1.2203098899656313
Energy: 1.2280406910606567
Energy: 1.4065759973280432
Energy: 1.3417335819338627
Energy: 1.297622249821248
Energy: 1.38163409444937
Energy: 1.3738621348349485
Energy: 1.344888443365434
Energy: 1.3477611995902257
Energy: 1.2284254556297394
Energy: 1.2462967399181277
Energy: 1.311596427717447
Energy: 1.2112727534708378
Energy: 1.277311643950094
Energy: 1.4199307602369666
Energy: 1.2398704781837961
Energy: 1.2367809931529299
Energy: 1.353029076649539
Energy: 1.2169725762601065
Energy: 1.2364676530105403
Energy: 1.3969572571618685
Energy: 1.281287849014755
Energy: 1.2491371034325434
Energy: 1.2947805885779458
Energy: 1.2801156744864655
Energy: 1.2179361367792707

minimum gb energy = 1.0948367616607395 eV
minimum distance =  2.28329861319437 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.718320248718518
Energy: 1.1376448771797905
Energy: 1.135287421868865
Energy: 1.7189761091803095
Energy: 1.1368009062197937
Energy: 1.1806689762626101
Energy: 1.340817113109338
Energy: 1.126090699832647
Energy: 1.1260025463711618
Energy: 1.3048844762903677
Energy: 1.1283768893133719
Energy: 1.126078938271672
Energy: 1.3628288630143657
Energy: 1.1301912958692741
Energy: 1.1305870316729754
Energy: 1.298530838855164
Energy: 1.1293638871604226
Energy: 1.1305637597267888
Energy: 1.5461367388159089
Energy: 1.2972255424490484
Energy: 1.205441128669122
Energy: 1.1485202111128587
Energy: 1.2958598012454783
Energy: 1.1310552123839195
Energy: 1.3258966063667
Energy: 1.1970347132219734
Energy: 1.257762918792696
Energy: 1.3135570418813076
Energy: 1.2133663015420098
Energy: 1.2239324651732628
Energy: 1.2625950344211643
Energy: 1.191951077323011
Energy: 1.1907971388396588
Energy: 1.263540820194004
Energy: 1.2049255110989232
Energy: 1.189159678200938
Energy: 1.3347572774507996
Energy: 1.1921685262733963
Energy: 1.1920673767242822
Energy: 1.3030530181986297
Energy: 1.3266906944577066
Energy: 1.2112046697629522
Energy: 1.330235492972861
Energy: 1.1135021095927549
Energy: 1.1691712487414023
Energy: 1.3309444194115683
Energy: 1.109001479960442
Energy: 1.169280272205386
Energy: 1.1290852877511104
Energy: 1.2331674785770772
Energy: 1.1693768115583332
Energy: 1.1293128403142199
Energy: 1.222700968628553
Energy: 1.1288084601398176
Energy: 1.1413138686834496
Energy: 1.277520226706813
Energy: 1.1422159055597239
Energy: 1.1422371294372426
Energy: 1.2328795633906107
Energy: 1.1428555659640716
Energy: 1.2816096654160452
Energy: 1.1512737280234349
Energy: 1.457952225426928
Energy: 1.2820455839333351
Energy: 1.1445981637997111
Energy: 1.4587237035829825
Energy: 1.225737407027005
Energy: 1.1919211466212867
Energy: 1.1441091217612354
Energy: 1.226258004005222
Energy: 1.3226244629150343
Energy: 1.1419515293714642
Energy: 1.1359597416546798
Energy: 1.149278472258709
Energy: 1.153308619885857
Energy: 1.13776536067135
Energy: 1.2719440638036903
Energy: 1.1533581490405558
Energy: 1.1381309036028315
Energy: 1.1328580062383813
Energy: 1.1869675250647187
Energy: 1.1374491300159966
Energy: 1.1777108588786018
Energy: 1.1865405804273657
Energy: 1.3974177819344424
Energy: 1.2612227130561602
Energy: 1.2099752546273446
Energy: 1.3981105469823096
Energy: 1.3406246928712264
Energy: 1.264054056540803
Energy: 1.3674611072961793
Energy: 1.1525618585982553
Energy: 1.1528724820960536
Energy: 1.366116808825118
Energy: 1.1386784460748323
Energy: 1.1997829160751379
Energy: 1.325906604037713
Energy: 1.1621128666548117
Energy: 1.1627922170420995
Energy: 1.310093246796859
Energy: 1.161519223263543
Energy: 1.163515058253799
Energy: 1.484804844630359
Energy: 1.2292130402513346
Energy: 1.1538952264500124
Energy: 1.1710104186849386
Energy: 1.216290298309234
Energy: 1.1543084089553122

minimum gb energy = 1.109001479960442 eV
minimum distance =  2.28993755218591 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.701337979882272
Energy: 1.2064350427311437
Energy: 1.1226595108677981
Energy: 1.6058692295896773
Energy: 1.1283485123017636
Energy: 1.2083808884207141
Energy: 1.0834122650284945
Energy: 1.0645074730615376
Energy: 1.0609574000280493
Energy: 1.2086711330730118
Energy: 1.0554664318771558
Energy: 1.0611836926085765
Energy: 1.3662921556542569
Energy: 1.1094368429155725
Energy: 1.1075201718650922
Energy: 1.1921862360126583
Energy: 1.109474987524105
Energy: 1.1310239231391304
Energy: 1.337763602582581
Energy: 1.3255532425994183
Energy: 1.1434373820164727
Energy: 1.1614500578215134
Energy: 1.311229530646635
Energy: 1.19175617932678
Energy: 1.3065154736526663
Energy: 1.1688197543175949
Energy: 1.0160862144840288
Energy: 1.2513074983059385
Energy: 1.0192731341843577
Energy: 1.0187579547794254
Energy: 1.501339395165948
Energy: 1.089572200101989
Energy: 1.2097194881714177
Energy: 1.487103504475203
Energy: 1.089978032050686
Energy: 1.2611913658181748
Energy: 1.3232559017591108
Energy: 1.2573629752718172
Energy: 1.3513771028274804
Energy: 1.4138261617895986
Energy: 1.2405199356716794
Energy: 1.2409888588476519
Energy: 1.2921183610145612
Energy: 1.0144788375115408
Energy: 1.014418798475105
Energy: 1.1171276758127142
Energy: 1.0266629939237524
Energy: 1.0750356357642619
Energy: 1.2082465295756606
Energy: 1.075390559787764
Energy: 1.0438536875036692
Energy: 1.2097287259727858
Energy: 1.1816374117645576
Energy: 1.0739974620146628
Energy: 1.2227023523528964
Energy: 1.3349625911433967
Energy: 1.2323732158333127
Energy: 1.2248431649870486
Energy: 1.0003262710416108
Energy: 1.2309275498145564
Energy: 1.257366389517835
Energy: 1.1440988684260007
Energy: 1.1442891417330716
Energy: 1.2395089702055648
Energy: 1.3404631850243494
Energy: 1.2664832727978792
Energy: 1.1043825397960807
Energy: 1.133423399070998
Energy: 1.216255387049486
Energy: 1.1116160192552724
Energy: 1.0007778699864853
Energy: 1.1333661287483057
Energy: 1.0883091972932484
Energy: 1.202268395353176
Energy: 1.2569501898660744
Energy: 1.092703750867308
Energy: 1.4703698259823836
Energy: 1.2570420880722386
Energy: 1.1080060869080304
Energy: 1.1994069499642972
Energy: 1.266744593103724
Energy: 1.1113421503604464
Energy: 1.4757190436118317
Energy: 1.2918102708574624
Energy: 1.2957198392243996
Energy: 1.3007200189861048
Energy: 1.1702895580367594
Energy: 1.2979687885834097
Energy: 1.3010473582745303
Energy: 1.0713039452410973
Energy: 1.4478164199141712
Energy: 1.1589246050317412
Energy: 1.0015975451426036
Energy: 1.4523538367269673
Energy: 1.1582813859688716
Energy: 0.9313132114227514
Energy: 1.1043363264623849
Energy: 1.2318194752590343
Energy: 1.2279474097148215
Energy: 1.1118266710739895
Energy: 1.2026940545398337
Energy: 1.1206135460529365
Energy: 1.2348248027307742
Energy: 1.2245708006506542
Energy: 1.224764254331016
Energy: 1.1260494967203383
Energy: 1.2166039309182026
Energy: 1.2760948614110867
Energy: 1.3412184967043765
Energy: 1.0007162915250563
Energy: 1.2746271570138634
Energy: 1.1279837800581896
Energy: 1.0409881293335759
Energy: 1.2807467984655865
Energy: 1.1029404244603704
Energy: 1.0897286327089593
Energy: 1.2753689352560245
Energy: 1.1209406163320577
Energy: 1.0901179413050703
Energy: 1.2622314757053976
Energy: 1.461381512009495
Energy: 1.0023832592412671
Energy: 1.0146979047367715
Energy: 1.4669324644819675
Energy: 1.1442808570108964
Energy: 1.2812398201122237
Energy: 1.3580767340373818
Energy: 1.373250713330882
Energy: 1.2790191444136658
Energy: 1.357497020894476
Energy: 1.227008167362697
Energy: 1.401900573136062
Energy: 1.2898189830570541
Energy: 1.0275626871438706
Energy: 1.0274261336390706
Energy: 1.2925066449629428
Energy: 1.5410436259060343
Energy: 1.0919997551924998
Energy: 1.1972775977409051
Energy: 1.1776672244998005
Energy: 1.1763135206726096
Energy: 1.054823659075431
Energy: 1.3598913539098718
Energy: 1.1764827679545997
Energy: 1.1801236107765005
Energy: 1.1356268209183829
Energy: 1.186315982024138
Energy: 1.178704876286926
Energy: 1.0030075138850587
Energy: 1.1971737776799976
Energy: 1.2933562495509392
Energy: 1.1383513692165421
Energy: 1.1452408102742482
Energy: 1.2208249564140337
Energy: 1.1390677290596793
Energy: 1.19490674791211
Energy: 1.37990830860693
Energy: 1.3105834772293867
Energy: 1.177594205328749
Energy: 1.2454629243152273
Energy: 1.0367950374715926
Energy: 1.2139696176942747
Energy: 1.0917553086035836
Energy: 1.1524417823991573
Energy: 1.1598238714578493
Energy: 1.091574744986146
Energy: 1.1538798737417042
Energy: 1.1512255105365283
Energy: 1.305241551786457
Energy: 1.118064552838737
Energy: 1.1170572415203097
Energy: 1.1877099630657788
Energy: 1.1248293202157549
Energy: 1.1686157119708365
Energy: 1.5580830861420611
Energy: 1.1267485768667027
Energy: 1.1245559391392255
Energy: 1.0227697877978303
Energy: 1.1269016491567372
Energy: 1.149334691606187

minimum gb energy = 0.9313132114227514 eV
minimum distance =  2.37054129100684 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.237676811304073
Energy: 1.1202442143375264
Energy: 1.1202479263152048
Energy: 1.2379469571742154
Energy: 1.0360557208495824
Energy: 1.5569642248247788
Energy: 1.1074044808568373
Energy: 1.0784372281047734
Energy: 1.0775929383235445
Energy: 1.2366487056942452
Energy: 1.0779220691190765
Energy: 1.0775143736499562
Energy: 1.0998398973922794
Energy: 1.0545007049797184
Energy: 1.0352596258066342
Energy: 1.0985725238489354
Energy: 1.0626473857083647
Energy: 1.0353050013922416
Energy: 1.4435897013437835
Energy: 1.232932193139196
Energy: 1.108643102530986
Energy: 1.137323321099265
Energy: 1.232991164370017
Energy: 1.0211277378033214
Energy: 1.237921474832812
Energy: 1.1505862352839529
Energy: 1.154997278528965
Energy: 1.2375156401497795
Energy: 1.1386944495298885
Energy: 1.0392305060306792
Energy: 1.2240132405047086
Energy: 1.1561604670658796
Energy: 1.1595181207013345
Energy: 1.2238241831693557
Energy: 1.2338834353600334
Energy: 0.9916269221925629
Energy: 1.0352476278855964
Energy: 1.0615083999419364
Energy: 1.0351843869257622
Energy: 1.0355880141464153
Energy: 1.0661570800430658
Energy: 1.0356204639742417
Energy: 1.0365164915245284
Energy: 1.0276648067485754
Energy: 1.0341508883406676
Energy: 1.0162883323639111
Energy: 1.0265289764080276
Energy: 1.1698669136068665
Energy: 1.1855380877480448
Energy: 1.1326779783478103
Energy: 1.1005120611000376
Energy: 1.1858474618837693
Energy: 1.1336911695240617
Energy: 1.0667050465487993
Energy: 0.9525199195136739
Energy: 1.0122170066378282
Energy: 1.0440236421746711
Energy: 1.0922351599271956
Energy: 1.0781790073730364
Energy: 1.0876652760692467
Energy: 1.1076958708895885
Energy: 1.0868186979506431
Energy: 1.0855857432730753
Energy: 1.100319650972087
Energy: 1.1049863734197862
Energy: 1.0874007826444132
Energy: 1.1074044143072894
Energy: 1.0770899887169292
Energy: 1.077500123357913
Energy: 1.236964919625549
Energy: 1.217629244821735
Energy: 1.0774584387338915

minimum gb energy = 0.9525199195136739 eV
minimum distance =  2.34900172145398 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.3260774835528077
Energy: 1.183841974523471
Energy: 0.9244464860120177
Energy: 0.9637841557625861
Energy: 1.221943019367287
Energy: 0.924629704653348
Energy: 0.8690315832579051
Energy: 0.9571275112759673
Energy: 0.9884771805053856
Energy: 0.9206923190506288
Energy: 0.9568512400297673
Energy: 0.9989187366470694
Energy: 0.9475579434746189
Energy: 0.9060130819680358
Energy: 0.906712861269361
Energy: 0.9501001830225688
Energy: 0.9099278239597312
Energy: 0.9072554190309442
Energy: 1.2284316099672012
Energy: 0.9530811620397511
Energy: 1.0363670218137222
Energy: 0.965331132066786
Energy: 0.9532297467313452
Energy: 1.0379885016373323
Energy: 1.0904592205559593
Energy: 1.0193244650877458
Energy: 0.9036809401474796
Energy: 1.090637036538811
Energy: 1.0779451589946834
Energy: 1.089919970527348
Energy: 1.0008400847502208
Energy: 0.9950232935976733
Energy: 0.9377326016641716
Energy: 1.0008079890856725
Energy: 1.0614408735758278
Energy: 0.9379054267967346
Energy: 1.0716257810528211
Energy: 1.073540597898512
Energy: 1.0044326286986047
Energy: 1.0748283615911147
Energy: 1.1560231042573186
Energy: 1.0393811043575367
Energy: 0.9197991345734751
Energy: 1.03024072230221
Energy: 0.9489741755434421
Energy: 0.9195864169298549
Energy: 0.947328260729163
Energy: 0.9188072010996581
Energy: 0.9255113235886463
Energy: 0.9658505088393138
Energy: 0.972733030838732
Energy: 0.938440525792665
Energy: 1.0026541466309054
Energy: 0.9481078527918095
Energy: 1.4377907106280607
Energy: 1.0229281291171168
Energy: 0.9997552991962438
Energy: 0.9125410128138004
Energy: 0.9280159418909484
Energy: 0.9989480073615884
Energy: 0.8713434663523189
Energy: 0.9204985761566449
Energy: 0.9188840166887687
Energy: 0.9093958058502492
Energy: 0.9185918807080485
Energy: 0.9193599264824125
Energy: 1.0313468470176388
Energy: 1.0015725739587684
Energy: 1.0012917796686158
Energy: 0.9441636535989996
Energy: 1.0015817297594176
Energy: 1.0012743127015136
Energy: 1.4042506754488209
Energy: 1.0115981172090518
Energy: 1.0498766122506988
Energy: 1.1098384598951732
Energy: 1.1694739170098358
Energy: 1.1294163743172871
Energy: 1.1200707769259077
Energy: 0.9381273440729322
Energy: 0.941668406068093
Energy: 1.1200450896435954
Energy: 1.1543102988208183
Energy: 1.0363883085723367
Energy: 1.0284783767585461
Energy: 0.9852831162723584
Energy: 1.0295333143420138
Energy: 1.0284415454312614
Energy: 1.0148666800236503
Energy: 1.2098697159199792
Energy: 0.9505128233829615
Energy: 0.9596960482358065
Energy: 0.9082405817693333
Energy: 0.9518069000564776
Energy: 0.9317822160292607
Energy: 0.9078231082591183
Energy: 1.0030818596810929
Energy: 1.0422514876850675
Energy: 0.933984875800836
Energy: 1.0030629191335096
Energy: 1.1497623510665054
Energy: 1.0044686326971073
Energy: 0.9512842212057102
Energy: 0.9507983909294453
Energy: 1.0506101063401976
Energy: 0.9515972956837744
Energy: 0.9853612637149751
Energy: 1.050861159044213
Energy: 1.0514394974117487
Energy: 1.011309580544364
Energy: 0.9194315674560621
Energy: 0.9312932765802975
Energy: 0.945232184570033
Energy: 0.9333830008804309
Energy: 0.9412437022939412
Energy: 0.947958410506062
Energy: 0.9489344179389029
Energy: 0.9429530069489227
Energy: 0.9303310665815759
Energy: 0.9493880537076393
Energy: 0.9436827228810696
Energy: 0.9081396717022473
Energy: 0.909043799651373
Energy: 0.929489591079809
Energy: 0.9203477619704754
Energy: 0.9466382515933829
Energy: 0.9819043631739806
Energy: 0.9490231919401011
Energy: 1.1379904885438377
Energy: 0.989716399017622
Energy: 0.9490327786834393
Energy: 0.9344074259559026
Energy: 0.9796792124289904
Energy: 1.0030184458640121
Energy: 1.0032066614588837
Energy: 1.0001424701073236
Energy: 1.0027312895168496
Energy: 1.0420225126917824
Energy: 0.9446774452900566
Energy: 0.9516388955281125
Energy: 0.9519470210480493
Energy: 0.933446891840252
Energy: 0.9508993791599597
Energy: 0.9076637988384899
Energy: 1.2404706449976983
Energy: 1.0292454712968995
Energy: 1.029291779923851
Energy: 0.9579279774705525
Energy: 1.0289496849283786
Energy: 1.2072664079847115
Energy: 1.0360357689126078
Energy: 0.9859071269503024
Energy: 0.9514172495322267
Energy: 1.035654405453724
Energy: 1.2475484001067998
Energy: 0.9215433759780616
Energy: 0.9380140935353651
Energy: 1.322515582527754
Energy: 1.3789667970771187
Energy: 0.9381533574914817
Energy: 1.3175954648119086
Energy: 0.9117441378607212
Energy: 1.0009966804551136
Energy: 0.9568508488532667
Energy: 0.9394415132947653
Energy: 1.0019480639297855
Energy: 1.1394408731212458
Energy: 0.9660597509254911
Energy: 0.9606706576121052
Energy: 0.9714493508481609
Energy: 0.9197651939327478
Energy: 0.961336955895151
Energy: 1.0007100850303132
Energy: 0.919445571764995
Energy: 0.9238871468190947
Energy: 1.199225751753099
Energy: 0.9835604179847914
Energy: 0.9236499442262373
Energy: 0.96211623889749
Energy: 0.9930184448377412
Energy: 0.8703807358441547
Energy: 0.9738941427466754
Energy: 0.967744457946293
Energy: 0.8705899529587015
Energy: 0.940035817937643
Energy: 0.970120674119777
Energy: 1.4770794784785142
Energy: 1.039147056343419
Energy: 1.039370958054918
Energy: 0.9116928670854232
Energy: 1.0390954237347774
Energy: 1.088935143968471
Energy: 1.1585173381176797
Energy: 1.0450222146212547
Energy: 1.0453599177305655
Energy: 0.9348678221395988
Energy: 1.0442500666664547
Energy: 0.9653527445780354
Energy: 1.2096830409555488
Energy: 1.0005066838168057
Energy: 1.0006385662672084
Energy: 0.9510713696230082
Energy: 1.0005640888961094
Energy: 0.9625449716560917
Energy: 0.925584091476054
Energy: 0.9839483951189193
Energy: 0.991468379256563
Energy: 0.92607366644654
Energy: 1.0922345308736525
Energy: 0.9901099695740229
Energy: 0.9355144177530919
Energy: 1.0159397034673623
Energy: 0.9618190738128684
Energy: 0.9354356333109151
Energy: 1.0006549536747127
Energy: 1.0364672217575615
Energy: 0.9081609845524912
Energy: 0.9598091209973519
Energy: 1.0124949497754623
Energy: 0.9092085442858098
Energy: 0.9524830541398033
Energy: 0.9074418892314997
Energy: 1.002655201659273
Energy: 0.9369045264607476
Energy: 0.940808131922911
Energy: 1.00269342120736
Energy: 0.9557994131760174
Energy: 1.0027286876552552
Energy: 1.2173063455653876
Energy: 1.0462845271609766
Energy: 0.9628582545039847
Energy: 1.2173015842762085
Energy: 0.9923727113350703
Energy: 1.0853292844649551
Energy: 1.0533287808115608
Energy: 0.9557692217847964
Energy: 0.9490037504925891
Energy: 1.052727084903725
Energy: 0.9729891219847238
Energy: 1.0883746822784977
Energy: 0.9401850222686041
Energy: 0.9498764718603364
Energy: 0.9672515960330703
Energy: 0.9420742268634239
Energy: 0.9493674242564617
Energy: 0.9318939315726267
Energy: 0.9463545642442759
Energy: 0.9197059815076896
Energy: 0.9495629484528612
Energy: 0.9328553775169547
Energy: 0.9434321641502325
Energy: 0.9512616989558984
Energy: 0.999062467856916
Energy: 0.9277904549276929
Energy: 0.928141634653802
Energy: 0.9793528135951667
Energy: 0.9471453732419002
Energy: 1.0315379709974475

minimum gb energy = 0.8690315832579051 eV
minimum distance =  2.2911953831366 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.42806213155161404
Energy: 0.44348864514168734
Energy: 0.4434147060501605
Energy: 0.43228203112378377
Energy: 0.49946736092803273
Energy: 0.42948056802393764
Energy: 0.42933065739413856
Energy: 0.5001894102170055
Energy: 0.5178094975689002
Energy: 0.49824732309001735
Energy: 0.4991639001112129
Energy: 0.5168730542882639
Energy: 0.5740148764209686
Energy: 0.5012749704917794
Energy: 0.5012050201119799
Energy: 0.5741266673744737
Energy: 0.5009270866738669
Energy: 0.501358835050336
Energy: 0.5740750427349612
Energy: 0.5013620652189942
Energy: 0.5013833056532172
Energy: 0.5742751746439353
Energy: 0.5730798372483958
Energy: 0.580226264520483
Energy: 0.5699505090859046
Energy: 0.4295269374156924
Energy: 0.43071098140999353
Energy: 0.5711959346799399
Energy: 0.429411496702902
Energy: 0.5009283463684009
Energy: 0.5012249420197633
Energy: 0.4292822402487404
Energy: 0.42955061127624466
Energy: 0.5012886363005522
Energy: 0.4291765078750849
Energy: 0.4770430815618973
Energy: 0.495174513065282
Energy: 0.5011910356158265
Energy: 0.5194426782201039
Energy: 0.49668332011897703
Energy: 0.501390212708147
Energy: 0.5188707824467337
Energy: 0.5010913436864535
Energy: 0.580295720873353
Energy: 0.5802961129178074
Energy: 0.5010396601333649
Energy: 0.5014832560699605
Energy: 0.5012893875032137
Energy: 0.5698749048113956
Energy: 0.5016789891941491
Energy: 0.501030070740628
Energy: 0.5711568888435236
Energy: 0.5741021376149057
Energy: 0.5011740773808777
Energy: 0.4291394965876698
Energy: 0.5736687161336244
Energy: 0.4428072982705642
Energy: 0.42917486764298884
Energy: 0.573561549592205
Energy: 0.43067524628411363
Energy: 0.4292463005598619
Energy: 0.5017660094139591
Energy: 0.5209324746217122
Energy: 0.42928433585151293
Energy: 0.5008292977501871
Energy: 0.47802149330736227
Energy: 0.5717324161812272
Energy: 0.5000905067795034
Energy: 0.5010233662437203
Energy: 0.5721411650315579
Energy: 0.4996884137174862
Energy: 0.5219297249079381
Energy: 0.5741992218168602
Energy: 0.5737526659791804
Energy: 0.5809083242364861
Energy: 0.5739765374017237
Energy: 0.5742090063416497
Energy: 0.5806306439941763
Energy: 0.5713253612958562
Energy: 0.4999004064924438
Energy: 0.5003929902558206
Energy: 0.5726729961226581
Energy: 0.49934749851965593
Energy: 0.5010115712067857
Energy: 0.5739495239203373
Energy: 0.42903808413716094
Energy: 0.429249292087069
Energy: 0.5738082089759691
Energy: 0.42902194854934234
Energy: 0.47958258808278686
Energy: 0.49890648120270337
Energy: 0.4997225672506504
Energy: 0.5189737552690805
Energy: 0.49926504237484565
Energy: 0.42949627021361897
Energy: 0.5171878916978311
Energy: 0.5009106084648395
Energy: 0.5009876437206315
Energy: 0.5012574954405673
Energy: 0.5008329980849504
Energy: 0.5744000543986507
Energy: 0.5013242455675235
Energy: 0.5736644439924398
Energy: 0.5810969483059305
Energy: 0.5806744743025233
Energy: 0.573625164163475
Energy: 0.5014857953954619
Energy: 0.5013130947430434
Energy: 0.42935140312074055
Energy: 0.5731391113854288
Energy: 0.500695965707485
Energy: 0.42942999531692155
Energy: 0.5716621118395421
Energy: 0.5005983255019562

minimum gb energy = 0.42806213155161404 eV
minimum distance =  2.38316342713338 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.5966363227747824
Energy: 1.1370530646236994
Energy: 1.086562196714595
Energy: 1.5983884353853366
Energy: 1.129019487262626
Energy: 1.450170328930255
Energy: 0.8043399423985917
Energy: 0.7874220103281643
Energy: 0.7872099011580377
Energy: 0.8067724125903286
Energy: 0.79381773264932
Energy: 0.805225792938726
Energy: 0.802298067297588
Energy: 0.7996763713193233
Energy: 0.8004740000307304
Energy: 0.8038173045349862
Energy: 0.7965204197422916
Energy: 0.798419668620643
Energy: 0.801999680233935
Energy: 0.8094460112422184
Energy: 0.8192262140878307
Energy: 0.8034618992114733
Energy: 0.7918088307388396
Energy: 0.7943363389590461
Energy: 0.7870516313448149
Energy: 0.8884845370152014
Energy: 0.824964781088088
Energy: 0.7873858850442849
Energy: 0.9655097881631477
Energy: 0.86096404808794
Energy: 0.8520292493411786
Energy: 0.9275863674221129
Energy: 0.8384426422846689
Energy: 0.8482002237506658
Energy: 0.9293331355380846
Energy: 0.8243179980912323
Energy: 0.8538887001070695
Energy: 0.829956949892979
Energy: 0.8018963418652442
Energy: 0.7936306332945582
Energy: 0.7874229485821497
Energy: 0.7892709709025866
Energy: 0.8197992923526151
Energy: 0.9206204002302145
Energy: 0.9206971599218008
Energy: 0.8196390683690993
Energy: 0.9280092494145615
Energy: 0.9778865792266941
Energy: 0.8516479463938885
Energy: 0.7943808300629916
Energy: 0.7936804038073698
Energy: 0.8523715306250997
Energy: 0.7929292475875983
Energy: 0.7940729814346861
Energy: 1.213439809865587
Energy: 0.7910762544489055
Energy: 0.8297386036098595
Energy: 1.2218769312820035
Energy: 0.7925236018500497
Energy: 0.8301657392697093
Energy: 0.9003342349281788
Energy: 0.9070499290863082
Energy: 0.7915646915322833
Energy: 0.9964910784527434
Energy: 0.9699741551829996
Energy: 0.851085354465384
Energy: 1.0499912365432211
Energy: 0.7753695247723749
Energy: 0.8158769276455348
Energy: 1.050360667775803
Energy: 0.7798702649251565
Energy: 0.7998121890857789
Energy: 0.9136614025945238
Energy: 0.7850969646630652
Energy: 0.7720769879543774
Energy: 0.9156604268494316
Energy: 0.7814443956421784
Energy: 0.8228736519251336
Energy: 0.8934278620857447
Energy: 0.9194010440736708
Energy: 0.8434825144346374
Energy: 0.8932877090342253
Energy: 0.9945449549374616
Energy: 0.8968582921766218
Energy: 1.3641578406424366
Energy: 0.7886845378276001
Energy: 0.9938487554893707
Energy: 1.323800198669435
Energy: 0.9740768654415565
Energy: 0.9346768641359876
Energy: 1.0794482202257807
Energy: 0.8878095392977269
Energy: 0.8980913567865879
Energy: 1.0802964256765082
Energy: 0.9305457145718908
Energy: 0.8027986055018648
Energy: 1.2250243264350473
Energy: 0.8296083276696864
Energy: 1.0320698413002969
Energy: 1.2143060852690621
Energy: 1.094166595009539
Energy: 0.8623045785147961
Energy: 1.1770915979605794
Energy: 0.8871345873210968
Energy: 0.8868468347417868
Energy: 1.1782149330400162
Energy: 0.8869098005431819
Energy: 0.8326101828624236
Energy: 0.8985066795558329
Energy: 0.8838932769086488
Energy: 0.8845906120841661
Energy: 0.8408336301103899
Energy: 0.9207055594239658
Energy: 0.8856968361239919
Energy: 1.0277563518862214
Energy: 0.9248455413837495
Energy: 0.8542240723724767
Energy: 1.0288977754685433
Energy: 0.9886690193395369
Energy: 0.8831087779848616
Energy: 1.0794760545042037
Energy: 0.8847686556970644
Energy: 0.928057159793283
Energy: 1.0806568168102468
Energy: 1.0449371443744373
Energy: 0.8128122985186209
Energy: 1.3241971264705237
Energy: 0.8220079323247149
Energy: 0.8349067527270234
Energy: 1.323640530237625
Energy: 0.7750980381284932
Energy: 0.9088064440672418
Energy: 0.7919034587310915
Energy: 0.8874236568608433
Energy: 0.8088576747559229
Energy: 0.7919965274994143
Energy: 0.8812309858075654
Energy: 0.793289399701499
Energy: 0.8367325563648157
Energy: 0.7970287940348671
Energy: 0.8546401213853836
Energy: 0.8383593656241154
Energy: 0.8053367899735201
Energy: 0.8299763848259422
Energy: 0.9863045348521027
Energy: 0.7939903173854336
Energy: 0.7919735707246417
Energy: 0.986360124297213
Energy: 0.8008537054757074
Energy: 0.8900967725769006
Energy: 0.8927747675639662
Energy: 0.7905298973110125
Energy: 0.806772915316792
Energy: 1.0779169406033555
Energy: 0.8470759616918137
Energy: 0.7949781041748352

minimum gb energy = 0.7720769879543774 eV
minimum distance =  2.33284249255836 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.6356860502581132
Energy: 1.277556876074212
Energy: 1.1182529065939693
Energy: 1.548549195755411
Energy: 0.9996598071605148
Energy: 1.0696036962512534
Energy: 0.9728876279031697
Energy: 0.8693063054464994
Energy: 0.869408485219261
Energy: 0.9037447349941423
Energy: 0.8692740619405966
Energy: 0.9287768479635319
Energy: 1.011604445863967
Energy: 1.0266593598947376
Energy: 0.8866091878248242
Energy: 0.8933308094041006
Energy: 0.8866785413809489
Energy: 1.0638819922145177
Energy: 1.009548310862383
Energy: 0.8854323198406654
Energy: 1.0547229671839142
Energy: 1.0328378518704704
Energy: 1.0241860863162129
Energy: 1.0067279099862247
Energy: 1.0597525438663171
Energy: 1.006824273197892
Energy: 0.9345739768820829
Energy: 1.0253976439635921
Energy: 1.115157674965627
Energy: 0.9152198026134826
Energy: 1.1840805423595213
Energy: 0.9440747555616797
Energy: 1.0369577001820507
Energy: 1.05978330553925
Energy: 1.0589627224022602
Energy: 1.0371737322856407
Energy: 1.1958298313036764
Energy: 1.02704298184071
Energy: 0.8888435554777326
Energy: 1.0571364171397135
Energy: 0.8712692670555344
Energy: 1.0953472967589613
Energy: 0.9962391931675841
Energy: 1.1586937664914396
Energy: 1.1587188553974002
Energy: 0.9947642804898548
Energy: 1.1587414341976223
Energy: 1.0540063146224525
Energy: 1.1871414774750362
Energy: 1.006904576711012
Energy: 1.006798706037268
Energy: 1.053316884745421
Energy: 1.0069285812765671
Energy: 1.0066074356510566
Energy: 1.3144995093741498
Energy: 1.08873891871627
Energy: 1.0153462805935016
Energy: 1.3147938477261765
Energy: 1.0891010508692787
Energy: 0.9985515827608404
Energy: 1.1738286805742641
Energy: 1.05505247543796
Energy: 0.9802195000366252
Energy: 1.0511598187454547
Energy: 1.1029614104728864
Energy: 0.9805932703751948
Energy: 1.1521900649615522
Energy: 0.9385898781599763
Energy: 0.911173179013472
Energy: 1.1399212454931704
Energy: 0.9385959030240814
Energy: 1.0603743447808258
Energy: 1.0757393515486495
Energy: 0.9646367948544722
Energy: 1.0241716012722508
Energy: 1.0561653846101844
Energy: 0.9385997039033702
Energy: 1.021158982054697
Energy: 1.056031103786529
Energy: 1.0013839054643852
Energy: 0.9911642548836631
Energy: 1.056042086377181
Energy: 1.0352806377091064
Energy: 1.0565559260395951
Energy: 1.2246383711375268
Energy: 1.2617514967606045
Energy: 1.308705459744162
Energy: 1.2248819578448045
Energy: 1.2612884839389429
Energy: 1.1844030354645534
Energy: 1.0483650517913095
Energy: 1.0024305316999718
Energy: 1.0101003667704191
Energy: 1.0458083236258082
Energy: 1.0177935383306607
Energy: 1.121429408474491
Energy: 1.5522842014337879
Energy: 1.0130962150352454
Energy: 0.8885116155546378
Energy: 1.5530555202796015
Energy: 1.0123716333369421
Energy: 0.9555836711546917
Energy: 1.0795563301283884
Energy: 1.133313272120547
Energy: 1.0611287735443329
Energy: 0.9411939053799705
Energy: 1.0983722480177016
Energy: 0.814184098234558
Energy: 1.0439048160690112
Energy: 1.0400209793412771
Energy: 1.0199746568577142
Energy: 1.044139084296621
Energy: 1.0401936021511933
Energy: 1.0697412896466179
Energy: 1.0452916410921549
Energy: 0.9973835262547068
Energy: 1.085530528458221
Energy: 1.0451905250021265
Energy: 1.0350620749774622
Energy: 1.0455118120542244
Energy: 1.041100871618087
Energy: 1.024807893326907
Energy: 1.0356182439169859
Energy: 1.0411578402945345
Energy: 1.03019612696712
Energy: 1.0420633491747218
Energy: 1.2813311392646116
Energy: 1.0986273915553446
Energy: 1.051275337491846
Energy: 1.2818835551534737
Energy: 1.0989670398236577
Energy: 1.269999272075918
Energy: 1.1847654789597173
Energy: 1.0090786077281242
Energy: 1.0103470832636654
Energy: 1.155577919566121
Energy: 1.0368794708038789
Energy: 1.0881740983118933
Energy: 0.9952417329716361
Energy: 1.08762666905974
Energy: 1.0313916512573076
Energy: 0.994122398986571
Energy: 1.0878233291981991
Energy: 1.0198840887192056
Energy: 1.187581874981706
Energy: 1.0174278221465312
Energy: 1.0075331945062116
Energy: 1.0686153444550732
Energy: 1.017207568766125
Energy: 1.0079290782539256
Energy: 1.177006819877982
Energy: 1.1089178578507235
Energy: 1.006501806391582
Energy: 0.9870123523787334
Energy: 1.1059977785200101
Energy: 1.0119264472249754
Energy: 1.1763277490819817
Energy: 0.877547576691415
Energy: 0.8841139016192568
Energy: 0.9878026900056114
Energy: 0.9453206116263704
Energy: 0.9885884255552173
Energy: 1.1993618876086367
Energy: 0.9667793106914881
Energy: 0.8712549041834746
Energy: 1.1309783534291358
Energy: 0.9857634324477115
Energy: 1.0333754092769432
Energy: 1.1802489048476437
Energy: 1.1433103902839132
Energy: 1.1796925319948153
Energy: 1.1770540672608765
Energy: 1.2434309552521345
Energy: 1.2181768132842536
Energy: 1.0237688972306338
Energy: 0.8566645112496339
Energy: 0.9986316434700815
Energy: 1.0413053412923343
Energy: 1.0159111492447257
Energy: 0.9147640004004283
Energy: 1.0339879190949381
Energy: 1.046375061783295
Energy: 1.1309125687846262
Energy: 1.0510392459945952
Energy: 1.0296155234999218
Energy: 1.0303588928559708
Energy: 1.0030620668202792
Energy: 1.0235272732946779
Energy: 0.8773260166567206
Energy: 0.9031824342060758
Energy: 0.8771126863796493
Energy: 0.9589689052308539
Energy: 1.3246855755642708
Energy: 0.8637840051709555
Energy: 0.8136742300839644
Energy: 0.9327052650800832
Energy: 0.94689543252397
Energy: 0.9347682614889782

minimum gb energy = 0.8136742300839644 eV
minimum distance =  2.30679431894427 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.10780795261759
Energy: 1.0591372514382549
Energy: 1.0541234139830513
Energy: 1.1099933035945393
Energy: 1.0013213823905145
Energy: 1.053502996266497
Energy: 1.1629083155471291
Energy: 0.9902689968971666
Energy: 0.9866133435592783
Energy: 0.9711795584742499
Energy: 0.9903972854906719
Energy: 0.9839322605111372
Energy: 1.0081346611000548
Energy: 1.0184750483763096
Energy: 1.0229737111863262
Energy: 0.9853792101167054
Energy: 1.0218863651687875
Energy: 0.9983031042243007
Energy: 1.0173293541781379
Energy: 0.9904148290835215
Energy: 0.9878930311141709
Energy: 1.0189063038798993
Energy: 0.9931476672736272
Energy: 0.9926886086107538
Energy: 0.9813002654849052
Energy: 1.0060302976811517
Energy: 0.949081380800563
Energy: 1.0026345212843246
Energy: 1.0001881761994627
Energy: 0.9984621520106252
Energy: 1.0226905471755883
Energy: 1.0496355570875096
Energy: 1.0739650780991172
Energy: 1.0289943492123703
Energy: 1.0465228063800016
Energy: 0.951637212686656
Energy: 1.1666968924849046
Energy: 0.961187709763211
Energy: 0.9489736868423212
Energy: 0.9956714347724093
Energy: 0.9815398465309193
Energy: 0.9919306658957131
Energy: 1.0606988853165504
Energy: 1.2294350403233922
Energy: 1.0001353501776462
Energy: 1.0609770430723175
Energy: 1.229270734110459
Energy: 1.00159354428081
Energy: 1.2997650910683993
Energy: 0.9649645093167375
Energy: 0.9656807061466559
Energy: 1.118498447676799
Energy: 0.9653650890443538
Energy: 0.9643792851807499
Energy: 1.5092152759281667
Energy: 0.9633643646153368
Energy: 0.9638986308059988
Energy: 1.0006705532939728
Energy: 0.9633360959981736
Energy: 0.9778258509321461
Energy: 1.1577722491618114
Energy: 0.9622514811214211
Energy: 0.9570397068229082
Energy: 1.0046294846580133
Energy: 1.0237438724789125
Energy: 0.9921394769692907
Energy: 1.0258470332408691
Energy: 0.960611606522254
Energy: 1.0026614764742736
Energy: 1.0256980186676594
Energy: 0.9601011614130904
Energy: 0.962060023114892
Energy: 0.9965593936979926
Energy: 0.9620662952007252
Energy: 0.9619624150308802
Energy: 0.9960553782884934
Energy: 0.9605321330782113
Energy: 0.9617711022803913
Energy: 0.9954814143743682
Energy: 1.0499737304101713
Energy: 0.9987197297942977
Energy: 0.9965247933677978
Energy: 1.0311722991586285
Energy: 0.9892225974891294
Energy: 0.9738326738218928
Energy: 1.0102631343703887
Energy: 1.0127873828113052
Energy: 1.0250044708554842
Energy: 1.0017503579821154
Energy: 1.0105100935691194
Energy: 1.0005123995440364
Energy: 0.9974768095928507
Energy: 0.9948353073674557
Energy: 1.015836855262713
Energy: 0.9952282934029097
Energy: 0.9867059061341259
Energy: 1.4868967250197616
Energy: 1.2648755502679525
Energy: 1.0136254022745357
Energy: 1.488462941836653
Energy: 1.2678912683309744
Energy: 1.014886909721468
Energy: 1.0157361191661558
Energy: 0.9983400826449693
Energy: 0.9909436991346078
Energy: 1.050487724178308
Energy: 0.9998010468626093
Energy: 0.9485271734861723
Energy: 1.0036469685690694
Energy: 1.0455138661975973
Energy: 1.048245288780346
Energy: 0.9987863974344466
Energy: 1.0633992166918746
Energy: 0.9612624085117645
Energy: 0.9573507754731746
Energy: 1.112421863064149
Energy: 0.9532798260703025
Energy: 0.9765802545719574
Energy: 1.0634853012080285
Energy: 0.9764069769741744
Energy: 0.9660703107960028
Energy: 1.0593314387266053
Energy: 0.975274805550151
Energy: 0.9662542620985863
Energy: 0.996582295050846
Energy: 0.9671215615381306
Energy: 0.9636813671066224
Energy: 1.034273014272394
Energy: 1.032916520168695
Energy: 0.9634929334145929
Energy: 1.0335501481182363
Energy: 0.9942768459085833
Energy: 1.1259792687656667
Energy: 0.9907952951655961
Energy: 0.9882909625533279
Energy: 1.1531520302790204
Energy: 0.9899090336469901
Energy: 0.9483849005219022
Energy: 1.0852277901208607
Energy: 1.03355742972038
Energy: 0.9940532936922573
Energy: 1.9041196857141764
Energy: 1.3114116225907897
Energy: 0.9606027394480577
Energy: 1.1640321756570688
Energy: 0.9906017425068748
Energy: 0.9874563668313486
Energy: 0.9619357006248594
Energy: 0.991480816143861
Energy: 0.9863000330343145
Energy: 1.0185654445255354
Energy: 1.0141742099649829
Energy: 1.0120079950183027
Energy: 1.012913306444839
Energy: 1.022439130297834
Energy: 1.0125007531663512
Energy: 1.018473391797687
Energy: 0.9953138398196547
Energy: 0.9876490157935002
Energy: 1.0199738290032054
Energy: 0.9968043980536807
Energy: 0.9932545606456776
Energy: 0.9987293146993235
Energy: 0.9498222263574728
Energy: 0.9487943401175476
Energy: 0.9993012081159028
Energy: 0.992033044455474
Energy: 0.990355029300313
Energy: 0.998167475170223
Energy: 1.050234627608818
Energy: 1.0746081236373881
Energy: 0.997879923062679
Energy: 1.4611549690417398
Energy: 1.0007356005176293
Energy: 1.1734403115701824
Energy: 0.960684487038353
Energy: 0.9486809045342054
Energy: 0.994272810293485
Energy: 0.9822214847044507
Energy: 0.9916125021569823
Energy: 1.0612499835144196
Energy: 0.9921056968764643
Energy: 1.0008668521438642
Energy: 1.0614956162111193
Energy: 0.9925275364441756
Energy: 0.9774554342640375
Energy: 1.2987531593025061
Energy: 0.9663358208633035
Energy: 0.9742779584121675
Energy: 1.1177469046360478
Energy: 0.9660746307600524
Energy: 0.9745226290906529
Energy: 1.0256901727286087
Energy: 0.9770713127005587
Energy: 0.9774545372688146
Energy: 0.9988095390848261
Energy: 0.9771990121501993
Energy: 0.9771611087052829
Energy: 1.156480006634781
Energy: 0.9984774104380236
Energy: 0.9611397739432513
Energy: 0.9982229132166736
Energy: 1.0207658425274748
Energy: 1.0242055867344528
Energy: 1.1388755830375124
Energy: 0.960478549760599
Energy: 1.0020460444971404
Energy: 1.1416724130826237
Energy: 0.9666103257236908
Energy: 0.990335984450123
Energy: 0.9986742201117322
Energy: 1.0049709779239049
Energy: 0.9616202309919548
Energy: 0.9970682625541043
Energy: 0.9605861651555564
Energy: 0.960760898978566
Energy: 0.9928993181884632
Energy: 0.9487417984203157
Energy: 0.9905709288288055
Energy: 0.9945390742096241
Energy: 0.9987452875983144
Energy: 0.9866530163749486
Energy: 0.969758610001092
Energy: 1.0218100065844993
Energy: 1.014500704927835
Energy: 0.9730762919831494
Energy: 1.0076822191516908
Energy: 1.0127475487038637
Energy: 0.9796074245956033
Energy: 0.9960086312012676
Energy: 0.9965187947414343
Energy: 1.004550179862409
Energy: 0.9980016570715495
Energy: 0.9908195936827165
Energy: 1.4441482609184355
Energy: 1.0000913173829178
Energy: 1.0000205480425057
Energy: 1.4443652810699106
Energy: 1.0000311280504328
Energy: 0.9734238779159203
Energy: 1.0251446172763425
Energy: 0.9988172363453175
Energy: 0.998782615178147
Energy: 1.0121630523917082
Energy: 1.0282253154738765
Energy: 1.0222606405761365
Energy: 0.998802542761869
Energy: 1.0422461677567667
Energy: 1.0310684247515818
Energy: 0.9969174619025335
Energy: 1.0628754676480485
Energy: 1.0361467926837231
Energy: 0.9780327353012124
Energy: 1.0610175151707752
Energy: 0.9515119890841434
Energy: 0.9784059151222286
Energy: 1.0642691239710709
Energy: 0.9996668130258988
Energy: 0.9628320288929825
Energy: 1.0446553818935354
Energy: 0.9662898369018235
Energy: 0.9641828762366235
Energy: 1.0048302371824747
Energy: 0.9660051236304701
Energy: 1.2596170897418661
Energy: 1.0325076821205006
Energy: 1.033558152290176
Energy: 1.2605255884104674
Energy: 1.031962720503049
Energy: 0.9822403495265911
Energy: 1.0143751925163311
Energy: 0.9952193290007704
Energy: 0.9964578100601669
Energy: 1.0279524765398982
Energy: 0.9962835280782039
Energy: 0.9497697179301147
Energy: 1.9030908359845744
Energy: 1.0371238634206534
Energy: 0.9947670626755284
Energy: 0.9621643781546878
Energy: 1.0366079845338063
Energy: 0.9617848543426856

minimum gb energy = 0.9483849005219022 eV
minimum distance =  2.2962628914963 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.2618962544776144
Energy: 0.95139442837888
Energy: 0.9523154471522552
Energy: 1.2650123432421736
Energy: 1.0518764870786645
Energy: 0.949360892092341
Energy: 1.2085026829484165
Energy: 0.9726127093740783
Energy: 0.8431263579705999
Energy: 1.1571562647633546
Energy: 0.9719280576505064
Energy: 0.8436200227538673
Energy: 0.9763007557362118
Energy: 0.951259507260196
Energy: 0.8450968606885831
Energy: 0.9781845573519424
Energy: 0.9525239864535938
Energy: 0.8450535495060446
Energy: 0.9751647172412949
Energy: 0.8434371408230086
Energy: 0.8444627691147889
Energy: 0.9778032060510709
Energy: 0.9747307495371523
Energy: 0.8441529089317451
Energy: 0.9639796541306122
Energy: 0.9563437320631129
Energy: 0.9552573626361243
Energy: 0.9634894383813196
Energy: 1.113739379771668
Energy: 0.9694646048453405
Energy: 0.9650662774666473
Energy: 0.9256721175323542
Energy: 0.967036650024171
Energy: 0.9649507073484792
Energy: 0.926158595638693
Energy: 0.9671916903298015
Energy: 1.209148397420546
Energy: 0.9611045729688615
Energy: 0.8447825218821583
Energy: 1.0031897156246747
Energy: 0.9707412961413542
Energy: 0.8445742214623133

minimum gb energy = 0.8431263579705999 eV
minimum distance =  2.39861548014199 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.697067058729397
Energy: 1.435159268225432
Energy: 1.1520506493373455
Energy: 1.647046939653468
Energy: 1.4569001858847674
Energy: 1.1895145679232233
Energy: 1.115862920405004
Energy: 1.095938322866275
Energy: 1.12597793154103
Energy: 1.1122591224696605
Energy: 1.104167368134207
Energy: 1.1022302845951213
Energy: 1.3118385402389896
Energy: 1.0119424917636544
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Energy: 1.2278010081303725
Energy: 1.4030905972350898
Energy: 1.225708678769973
Energy: 1.0616969312506996
Energy: 1.102879426687884
Energy: 1.052285189154414
Energy: 1.0729426734040959
Energy: 1.138157441966217
Energy: 0.9877210608741946
Energy: 1.0379095059042622
Energy: 1.1377075129837244
Energy: 0.9745849972825863
Energy: 1.0463857232854317
Energy: 1.099607066739971
Energy: 0.9743465171200731
Energy: 1.2425060593457211
Energy: 1.1758248110702247
Energy: 1.174539507563945
Energy: 1.236868901550118
Energy: 1.2082676818231126
Energy: 1.223634351325484
Energy: 1.0820726869165576
Energy: 1.151871584759795
Energy: 1.1467617674834782
Energy: 1.0745132659968246
Energy: 1.167885160138225
Energy: 1.1261945908183992
Energy: 1.2333526633382759
Energy: 1.4053418927320185
Energy: 1.1489488476708027
Energy: 1.2506871131462056
Energy: 1.4045502207812093
Energy: 1.2368010510848226
Energy: 1.254627048379879
Energy: 1.1525093172371512
Energy: 1.17798317079868
Energy: 1.2435618322504873
Energy: 1.3101837568337458
Energy: 1.1833901194992356
Energy: 1.398004159890627
Energy: 1.0590984234760494
Energy: 1.1766179071319924
Energy: 1.3941442516568723
Energy: 1.1504601292056755
Energy: 1.200821653182582
Energy: 1.176984124237724
Energy: 1.1747973541066008
Energy: 1.1558996594082018
Energy: 1.177341345692144
Energy: 1.1350427841352373
Energy: 1.2092063202073766
Energy: 1.1781184631048929
Energy: 1.2395911350151008
Energy: 1.1623356793149522
Energy: 1.180341380688859
Energy: 1.251869838650335
Energy: 1.2183505887266006
Energy: 1.2537507555804266
Energy: 1.1244979318026727
Energy: 1.1285664356438698
Energy: 1.256398220767459
Energy: 1.1275244651255325
Energy: 1.1221459082650318
Energy: 1.1783417060864667
Energy: 1.0556352890219194
Energy: 1.0385584896153923
Energy: 1.1807798048883282
Energy: 1.0584162249431677
Energy: 1.0379170181694133
Energy: 1.3558449253017435
Energy: 1.0940672190201228
Energy: 1.1579569353713406
Energy: 1.3589822605511233
Energy: 1.091304032765155
Energy: 1.3023030236709818
Energy: 1.3013943800353633
Energy: 1.1008108076702707
Energy: 1.0961905733590225
Energy: 1.3043468325928629
Energy: 1.2819887637838185
Energy: 1.1045789187684285
Energy: 1.3996448721408452
Energy: 1.127111678201733
Energy: 1.145836431774749
Energy: 1.4016074422374794
Energy: 1.2319646185581663
Energy: 1.2990880311491793
Energy: 1.3234081249582457
Energy: 1.1809879943097028
Energy: 1.0990264290946632
Energy: 1.3166694723913657
Energy: 1.1213936637508117
Energy: 1.115070886696615
Energy: 1.1095518647902214
Energy: 1.279407428777495
Energy: 1.2616522634577236
Energy: 1.111433383303085
Energy: 1.2888701927502564
Energy: 1.0420267086560375
Energy: 1.3971898943650922
Energy: 1.1241578237931447
Energy: 1.1186695153525419
Energy: 1.0999276968584324
Energy: 1.1212420424958227
Energy: 1.0455590280453326
Energy: 1.2887661970578115
Energy: 1.0946095258197215
Energy: 1.1015633987341302
Energy: 1.2784633065960573
Energy: 1.0944804415735836
Energy: 1.1213504190362091
Energy: 1.2172238969317344
Energy: 1.233001218402736
Energy: 1.2289216479391718
Energy: 1.2190520762793828
Energy: 1.2456262899579515
Energy: 1.2517575658848257
Energy: 1.1252451073812795
Energy: 1.122755126450333
Energy: 1.1218924496676126
Energy: 1.127948168113529
Energy: 1.1022557348573785
Energy: 1.123795694058215
Energy: 1.152972454077512
Energy: 1.1721678358781114
Energy: 1.1717320493319603
Energy: 1.138851982315742
Energy: 1.2931543250462236
Energy: 1.1347038028333594
Energy: 1.3698160632484477
Energy: 1.2032514535883374
Energy: 1.1539198849704198
Energy: 1.2916394320878102
Energy: 1.1738788814342285
Energy: 1.1675068736231073
Energy: 1.2252672935641151
Energy: 1.2234655461010893
Energy: 1.2017153961831095
Energy: 1.093721594093819
Energy: 1.3082655416192797
Energy: 1.107016030763656
Energy: 0.9864708657098995
Energy: 1.2002389958495336
Energy: 1.1793874612370072
Energy: 1.107722548246194
Energy: 1.3256068816967181
Energy: 1.1134828502082375
Energy: 1.2882843497011423
Energy: 1.1542473777144748
Energy: 1.162849790993893
Energy: 1.2908031584876036
Energy: 1.191570656135639
Energy: 1.166524721356288
Energy: 1.0779121177908964
Energy: 1.0580674903517742
Energy: 1.0559877882752153
Energy: 1.0771640232581248
Energy: 1.4664596454864365
Energy: 1.0606630173574636
Energy: 1.0408938161766441
Energy: 1.0876036591959528
Energy: 1.0348926707717188
Energy: 1.0426878928099923
Energy: 1.1457267238164706
Energy: 1.0348091538947168
Energy: 1.2028539061233146
Energy: 1.263455126913041
Energy: 1.1411322057519218
Energy: 1.2002196140743846
Energy: 1.3730055140141033
Energy: 1.1170402574050473
Energy: 1.3269899301726644
Energy: 1.1552780942148844
Energy: 1.1801919053069123
Energy: 1.3185272757455047
Energy: 1.1604343387904374
Energy: 1.183338138342196
Energy: 1.4938059200229739
Energy: 1.2169315278618364
Energy: 1.2281969367483296
Energy: 1.5065021936239515
Energy: 1.2363704402635851
Energy: 1.1480389862305893
Energy: 1.0655987734581442
Energy: 1.3491112096940168
Energy: 1.1590426663711682
Energy: 1.1192758005334018
Energy: 1.4063734178604417
Energy: 1.186005229240784
Energy: 1.297908133141625
Energy: 1.1594140241954525
Energy: 1.1593424401811019
Energy: 1.3301016310857872
Energy: 1.1343377854469892
Energy: 1.197382176102179
Energy: 1.2426265107799153
Energy: 1.052240466624175
Energy: 1.158502753143195
Energy: 1.2397355452470757
Energy: 1.1606331028460992
Energy: 1.1576558736974212
Energy: 1.189533120342865
Energy: 1.154315617288216
Energy: 1.1799808426324365
Energy: 1.192264253485855
Energy: 1.2342346525150145
Energy: 1.181147047090681
Energy: 1.262408916494435
Energy: 1.1487162564416153
Energy: 1.1492011370152573
Energy: 1.2656015817524393
Energy: 1.1477813112135238
Energy: 1.127452793621416
Energy: 1.1847428888955522
Energy: 1.0387238313979255
Energy: 1.0390111816390954
Energy: 1.184552540047078
Energy: 1.0436650916217658
Energy: 1.0354590412378115
Energy: 1.3381848531586125
Energy: 1.0716191968245048
Energy: 1.0732704799660078
Energy: 1.3132569823708802
Energy: 1.0705861630425257
Energy: 1.06375693613611
Energy: 1.1816112144797557
Energy: 1.1860578143086213
Energy: 1.0876637580984048
Energy: 1.186795109654761
Energy: 1.3427697080431167
Energy: 1.1364271254225098
Energy: 1.3160586847331976
Energy: 1.1638646529062466
Energy: 1.1682028180126534
Energy: 1.3133532892149595
Energy: 1.2506146250448056
Energy: 1.1508408325518202
Energy: 1.4160270813052735
Energy: 1.1156683741936884
Energy: 1.2062424665424514
Energy: 1.4785226939100826
Energy: 1.1275269226657598
Energy: 1.2901765998683314
Energy: 1.3137652802254285
Energy: 1.1125017642864068
Energy: 1.0930402086581326
Energy: 1.2461314230296352
Energy: 1.3764693608222038
Energy: 1.101641465658164
Energy: 1.4522071878860445
Energy: 1.1239644796460955
Energy: 1.1159630702033643
Energy: 1.4534990463478168
Energy: 1.1287383108139741
Energy: 1.119070780349669
Energy: 1.1268474815618494
Energy: 1.0981189593288876
Energy: 1.0900684741848061
Energy: 1.1206693506442567
Energy: 1.0971425617492443
Energy: 1.0578011992778773
Energy: 1.2527651201755912
Energy: 1.2249175504051042
Energy: 1.2325446641020128
Energy: 1.249810516490321
Energy: 1.2123568638257647
Energy: 1.2378395147011856
Energy: 1.0921345239828444
Energy: 1.127593286397196
Energy: 1.0502297795234605
Energy: 1.10115747620008
Energy: 1.04201514268824
Energy: 1.0501682278238453
Energy: 1.134933601845306
Energy: 1.0531221232261436
Energy: 1.1418596000968424
Energy: 1.1453663920038393
Energy: 1.1742843596953887
Energy: 1.115412309639549
Energy: 1.427796407203979
Energy: 1.1161017484980549
Energy: 1.0728665513410327
Energy: 1.322485750433846
Energy: 1.1272643119659562
Energy: 1.1693444602010445
Energy: 1.0277249011636544
Energy: 1.096869075312034
Energy: 1.1083122250162227
Energy: 0.9776505375777518
Energy: 1.1666239572171104
Energy: 1.0907490230562331

minimum gb energy = 0.9743465171200731 eV
minimum distance =  2.31420067157934 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.8256933815842684
Energy: 1.1305526744739325
Energy: 1.014877209147389
Energy: 1.6949554194831995
Energy: 1.1286086968248785
Energy: 1.1311038612815498
Energy: 1.0956209476785506
Energy: 1.0605007751132478
Energy: 1.1037232573074107
Energy: 1.0375567091214828
Energy: 1.0606470007096243
Energy: 1.0447141873539136
Energy: 1.362687859558751
Energy: 1.1877316678198633
Energy: 1.2097241883311889
Energy: 1.1846628438924782
Energy: 1.182236625168797
Energy: 1.1820808925661945
Energy: 1.1739909955836276
Energy: 1.1772120472726926
Energy: 1.1834795120499855
Energy: 1.1959536922250393
Energy: 1.177234323540251
Energy: 0.9851290264919249
Energy: 1.1787836893831705
Energy: 1.1027840678856387
Energy: 1.092796710424711
Energy: 1.1941429675693156
Energy: 1.036605803891048
Energy: 0.9981122695677718
Energy: 1.2940986653141573
Energy: 1.2389399171516204
Energy: 1.1010435145610427
Energy: 1.3558424361219092
Energy: 1.1645275931913646
Energy: 1.1354310051896748
Energy: 1.2654822971027924
Energy: 1.227328268599049
Energy: 1.227903025787253
Energy: 1.3104389051269603
Energy: 1.2182246264681718
Energy: 1.1435368145525462
Energy: 1.4533203381479831
Energy: 1.2829912292838486
Energy: 1.4004991265982945
Energy: 1.455044997979045
Energy: 1.3671479069674424
Energy: 1.1198520858776946
Energy: 1.2603929287248627
Energy: 1.1606428631553465
Energy: 1.1973225639129523
Energy: 1.2727928911441684
Energy: 1.1635730513948401
Energy: 1.1681139330851484
Energy: 1.2098479080720037
Energy: 0.9900753176648155
Energy: 0.9899839028863818
Energy: 1.189252606225954
Energy: 1.1001192884451318
Energy: 1.073450666050177
Energy: 1.2020719693859405
Energy: 0.9660440753907844
Energy: 0.9921306787694536
Energy: 1.166381210547854
Energy: 1.0411904241022947
Energy: 1.1578545692240658
Energy: 1.1839885913354424
Energy: 1.2132293690100542
Energy: 1.2667832849222027
Energy: 1.1849240152403762
Energy: 1.244330309183516
Energy: 1.2334363315814114
Energy: 1.1749325563230182
Energy: 1.2394104923546054
Energy: 1.239670063479428
Energy: 1.177478526081891
Energy: 1.2283541862701335
Energy: 1.234796981593951
Energy: 1.1500787054041266
Energy: 1.1916946190048363
Energy: 1.103511735488764
Energy: 1.1697568417711672
Energy: 1.185863123741659
Energy: 1.1571277126110668
Energy: 1.5344242443691478
Energy: 1.2413576399923116
Energy: 1.2470883776146908
Energy: 1.2047270751176256
Energy: 1.21688767352282
Energy: 1.25312552729197
Energy: 1.2251863821771376
Energy: 1.2540404359594848
Energy: 1.2548604169241375
Energy: 1.2251578388302689
Energy: 1.3475409008593238
Energy: 1.231867586903506
Energy: 1.3654609576314263
Energy: 1.1771905008679435
Energy: 1.1195815908061173
Energy: 1.3653690292373455
Energy: 1.1386397625073639
Energy: 1.1184479384193942
Energy: 1.3040769316827392
Energy: 1.1834162034318252
Energy: 1.2815702004507408
Energy: 1.2966608525760737
Energy: 1.224749875745027
Energy: 1.271327872141633
Energy: 0.9659498393681872
Energy: 1.337912905514442
Energy: 0.9909275769241218
Energy: 0.9661800102192164
Energy: 1.3436925751384137
Energy: 0.9900563501616059
Energy: 0.9654118161917842
Energy: 1.1977002154163863
Energy: 0.9907764759936317
Energy: 0.9653205919510185
Energy: 1.2073535086860598
Energy: 0.9903768284804172
Energy: 1.3047321892514119
Energy: 1.1893303168484841
Energy: 1.2747371642312402
Energy: 1.2922820209757868
Energy: 1.2162291281189939
Energy: 1.2710115741727483
Energy: 1.2370140895358648
Energy: 1.1948143752407034
Energy: 1.253252471126324
Energy: 1.2371331185316528
Energy: 1.1945094821323452
Energy: 1.2494445083308543
Energy: 1.1847880335694692
Energy: 1.2250534701931863
Energy: 1.2334367632204233
Energy: 1.1872741810153236
Energy: 1.1867776096688127
Energy: 1.2056005872417914
Energy: 1.207870444453283
Energy: 1.251426656319886
Energy: 1.252084314888787
Energy: 1.2079883766846702
Energy: 1.5513340471929777
Energy: 1.2517596439278833
Energy: 1.327279598554151
Energy: 1.1769775094579826
Energy: 1.1443063026344564
Energy: 1.3239034869167359
Energy: 1.1836257462400934
Energy: 1.1760944343753876
Energy: 1.490874435761737
Energy: 1.3566115306780218
Energy: 1.357281680300014
Energy: 1.1470711447919137
Energy: 1.3691940273930359
Energy: 1.2763507670159486
Energy: 1.1141537534857566
Energy: 1.2014540240980907
Energy: 1.201355234428594
Energy: 1.1146790610450037
Energy: 1.2490944365815082
Energy: 1.1763726214116939
Energy: 1.3079590101141083
Energy: 1.0360701546741937
Energy: 1.2088999564062897
Energy: 1.3001382959528474
Energy: 0.9653886235059003
Energy: 1.0953461524664352
Energy: 1.180334016830524
Energy: 1.0519779698190628
Energy: 1.0484265705527902
Energy: 1.1514447626219344
Energy: 0.9738279678891284
Energy: 1.1459125092654954
Energy: 1.1120583125942396
Energy: 1.1176461371625535
Energy: 1.1675161512655066
Energy: 1.130635405786027
Energy: 1.1600398347431067
Energy: 1.1937361358094296
Energy: 1.192483242342122
Energy: 1.3805493554741202
Energy: 1.240438171073989
Energy: 1.1923858286157567
Energy: 1.2870837944552342
Energy: 1.2466203657409536
Energy: 1.159822834960908
Energy: 1.17937209667374
Energy: 1.091226885895991
Energy: 1.1637960794320794
Energy: 1.1896598442021618
Energy: 1.188931453477857
Energy: 1.160305931677793
Energy: 1.0859960601465868
Energy: 1.1419117823559906
Energy: 1.1578286457557379
Energy: 1.181112047817845
Energy: 1.161637809201545
Energy: 1.169979809806019
Energy: 1.1769346749409149
Energy: 1.0759456157938085
Energy: 1.1801650253465026
Energy: 1.2091453087734172
Energy: 1.0474256184681872
Energy: 1.2109770891779643
Energy: 1.1075977607099996
Energy: 1.2427001899514682
Energy: 1.234070980499623
Energy: 1.4919438466444273
Energy: 1.0286280773425738
Energy: 1.406474320288088
Energy: 1.1766181635819013
Energy: 1.112268846115229
Energy: 1.2767714755127344
Energy: 1.115702110890847
Energy: 1.2544352592398174
Energy: 1.371600127647694
Energy: 1.050528939166917
Energy: 1.0945277880067337
Energy: 1.0401889740910346
Energy: 1.204628374538675
Energy: 1.0432499940419795
Energy: 1.363894176592307
Energy: 1.1167821120870263
Energy: 1.0152800119942258
Energy: 1.6559967246816323
Energy: 1.1165344925052878
Energy: 1.131365426041947

minimum gb energy = 0.9653205919510185 eV
minimum distance =  2.36889774758489 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.729836473680923
Energy: 1.3090081061338388
Energy: 1.215012002181029
Energy: 1.7514585181176254
Energy: 1.3862084876638257
Energy: 1.0724873988978596
Energy: 1.3124258120590997
Energy: 1.1006283053478636
Energy: 1.1791287463414362
Energy: 1.237719071329021
Energy: 1.1040969512906451
Energy: 1.1327275960916647
Energy: 1.0278165127529704
Energy: 1.0145263824514916
Energy: 1.0144611906762313
Energy: 1.0275332061468612
Energy: 1.2052884048048003
Energy: 1.1594561409500939
Energy: 1.026285196864277
Energy: 1.0422008570306487
Energy: 1.0290139406013565
Energy: 1.027274377587748
Energy: 1.1961256196301049
Energy: 1.0286548842434002
Energy: 1.0510276790480841
Energy: 1.1800956283065323
Energy: 1.0982444231792792
Energy: 1.044894195370884
Energy: 1.1759877478713927
Energy: 1.016925579207696
Energy: 1.180958408255025
Energy: 1.1430924489986456
Energy: 1.1448226524988983
Energy: 1.1822944471504284
Energy: 1.1428171914996677
Energy: 1.19781386023351
Energy: 1.0802590597703288
Energy: 1.0284287165340775
Energy: 1.0194804446254915
Energy: 1.0797657612888536
Energy: 1.0279397093587956
Energy: 1.028443868268583
Energy: 1.4222897784056088
Energy: 1.033305251442608
Energy: 1.0335616909616885
Energy: 1.4223618200780825
Energy: 1.0334620700695016
Energy: 1.346234983359968
Energy: 1.139502125190534
Energy: 1.0676165564131128
Energy: 1.0283287596480013
Energy: 1.14105555954225
Energy: 1.3452526850876096
Energy: 1.0214699479058855
Energy: 1.4177918124333235
Energy: 1.0208653382445916
Energy: 1.12459369362344
Energy: 1.4467450485013789
Energy: 1.1733538273701476
Energy: 1.1916446625625823
Energy: 1.1943354097552343
Energy: 1.1999673534883653
Energy: 1.2002790958580003
Energy: 1.2138786198360902
Energy: 1.1770824043421324
Energy: 1.037163651125897
Energy: 1.1571843144783611
Energy: 1.200293624632816
Energy: 1.025145805825279
Energy: 0.9981158683709248
Energy: 1.2983990338594245
Energy: 1.131550982829086
Energy: 1.1830446535287737
Energy: 1.104057542449042
Energy: 1.0317026871530075
Energy: 1.1829252748986507
Energy: 1.1027081144090227
Energy: 1.030592284255823
Energy: 1.2175300278942385
Energy: 1.0967201699464237
Energy: 1.1753918986845753
Energy: 1.2189332877741863
Energy: 1.0960175642505954
Energy: 1.178202080922173
Energy: 1.0686538360711395
Energy: 1.2363941755978978
Energy: 1.065543416828768
Energy: 1.0678131245868414
Energy: 1.1855985046098922
Energy: 1.065799789758848
Energy: 0.9913989056273483
Energy: 0.986705361292512
Energy: 0.9934759973077864
Energy: 0.9916000488115881
Energy: 1.1476530189075052
Energy: 0.9844770796539989
Energy: 1.004344700072533
Energy: 1.0071485115154841
Energy: 1.0022544408421463
Energy: 1.0043727542652772
Energy: 1.2719118526975084
Energy: 1.0044873128828702
Energy: 1.2881805924305045
Energy: 1.1225347446011693
Energy: 1.2071901653865849
Energy: 1.2880564323524384
Energy: 1.1699523271850414
Energy: 1.1248705280973803
Energy: 1.123483770100675
Energy: 1.1904593807925323
Energy: 1.1486306549077006
Energy: 1.1146851522601342
Energy: 1.2843438622608603
Energy: 1.0215074921283318
Energy: 1.1581025296891363
Energy: 1.307702573256592
Energy: 1.114965806749217
Energy: 1.1436872108309073
Energy: 1.3864264288558246
Energy: 1.0227537335835608
Energy: 1.2537953533191646
Energy: 1.1760522558615223
Energy: 1.2288152485009922
Energy: 1.2678286080056138
Energy: 1.1804630837939925
Energy: 1.2196797563521966
Energy: 1.2066439496216892
Energy: 1.0529310541369241
Energy: 1.2060990204759634
Energy: 1.206399474668879
Energy: 1.5073696057746755
Energy: 1.2229583002605307
Energy: 1.1867402544810397
Energy: 1.0819146233611632
Energy: 1.230080476451096
Energy: 1.1824737223980628
Energy: 1.1889652683631178
Energy: 1.229557546722825
Energy: 1.3352197240219241
Energy: 1.0029265617835332
Energy: 1.221758498270571
Energy: 1.3379414658427324
Energy: 1.0027257073163913
Energy: 1.182678234228072
Energy: 1.15660414047896
Energy: 1.0059180401464811
Energy: 1.0056912008595198
Energy: 1.1563890973683673
Energy: 1.0052441742999827
Energy: 1.0056907570461564
Energy: 1.1845557426003814
Energy: 0.9870257883925871
Energy: 0.9867552421919932
Energy: 1.1863205172177604
Energy: 0.9870659082771316
Energy: 0.9867059045236488
Energy: 1.191623799693614
Energy: 1.0652353426249608
Energy: 1.1621974986034962
Energy: 1.1915691632200445
Energy: 1.2001902910381503
Energy: 1.1396354245887717
Energy: 1.0997245252520047
Energy: 1.1741781999430196
Energy: 1.130574326468444
Energy: 1.1001579782794808
Energy: 1.0853042718606019
Energy: 1.0256001191604462
Energy: 1.2498519816885667
Energy: 1.0219892778671673
Energy: 1.1993245641202916
Energy: 1.2498468572489336
Energy: 1.4346003824588662
Energy: 1.0442808951080136
Energy: 1.2293073212783203
Energy: 1.0871603240390664
Energy: 1.175211151473047
Energy: 1.229375153302655
Energy: 1.1414450574995083
Energy: 1.020369435232176
Energy: 1.1064317301061737
Energy: 1.184273412746854
Energy: 1.256299971344487
Energy: 1.0945186508897196
Energy: 1.1834030886066935
Energy: 1.1850437917048886

minimum gb energy = 0.9844770796539989 eV
minimum distance =  2.27027262797801 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.2085526664319237
Energy: 1.075320103509168
Energy: 1.075504684226471
Energy: 1.209975060118824
Energy: 1.1273964994239734
Energy: 1.0759366907808756
Energy: 0.9459764271259483
Energy: 1.0231627037959359
Energy: 1.0638011228814817
Energy: 1.0301282473513953
Energy: 1.0241035602160964
Energy: 1.1186462878439705
Energy: 1.296238028921726
Energy: 1.1198679361454986
Energy: 1.0606690689428622
Energy: 1.2976883092134364
Energy: 1.2039975762052375
Energy: 1.0530706826823835
Energy: 1.0108949894656083
Energy: 1.1198481801177627
Energy: 0.9528340329008325
Energy: 1.0086325534242102
Energy: 1.2181073637165292
Energy: 1.0089803062647538
Energy: 1.0218165845674305
Energy: 1.006460917264868
Energy: 1.0073747131181872
Energy: 1.0215770933035973
Energy: 1.1853707461016103
Energy: 1.0083189393478151
Energy: 1.1289972554225873
Energy: 1.0984130364720726
Energy: 1.0064677367299857
Energy: 1.1956881746075898
Energy: 1.0974569732345694
Energy: 1.1233849048080176
Energy: 1.0981273022878466
Energy: 1.0093725675263512
Energy: 1.0095841681063993
Energy: 1.0985392244599
Energy: 1.008376786909227
Energy: 1.0096130581693525
Energy: 1.1635662700038332
Energy: 1.0118685926241047
Energy: 1.010827449037961
Energy: 1.164324618929844
Energy: 1.0822653934927897
Energy: 1.0102970062185388
Energy: 1.0277573963194067
Energy: 1.063924687375976
Energy: 1.0106274337762844
Energy: 1.0234799109293482
Energy: 1.1266673194855912
Energy: 1.0636826488897106
Energy: 1.1141702838159087
Energy: 1.1471018154779102
Energy: 1.171993344809976
Energy: 1.1141555718942044
Energy: 1.079998481207971
Energy: 1.0411829579831273
Energy: 1.0287290991524398
Energy: 1.1608914061625988
Energy: 1.1211032466882906
Energy: 1.0261333280614147
Energy: 1.085814347659897
Energy: 1.0921621533235066
Energy: 0.9575070301116486
Energy: 1.1718944242203726
Energy: 1.0094902005868696
Energy: 0.9597557261008185
Energy: 1.1672926216707664
Energy: 1.0449781790747226
Energy: 0.9599946359133543
Energy: 1.0882290671139612
Energy: 1.046364717309707
Energy: 0.9573829381534936
Energy: 1.0762775195287055
Energy: 1.0452318608466977
Energy: 1.0788360242854855
Energy: 1.0312043097277142
Energy: 1.061601798973693
Energy: 1.079204465375898
Energy: 1.0838588476601614
Energy: 1.0623191138368218
Energy: 1.01082111834881
Energy: 1.1015405591174399
Energy: 1.0983104362361453
Energy: 1.0106474979090612
Energy: 1.2390709458026723
Energy: 1.1001816961294513
Energy: 1.0086003843076774
Energy: 1.05342322813889
Energy: 1.0541824614292414
Energy: 1.0080769667976106
Energy: 1.1185974167075436
Energy: 1.0090630385742405
Energy: 1.1637090386635343
Energy: 1.1225440223122891
Energy: 1.1169769603747521
Energy: 1.1167211650939597
Energy: 1.1122506163277595
Energy: 1.0054376540787517
Energy: 1.2163827630363329
Energy: 1.0103664747269094
Energy: 1.0094078110763305
Energy: 1.1876898414790902
Energy: 1.010152340032792
Energy: 1.007304536356358
Energy: 1.095375326708935
Energy: 1.0093851862404228
Energy: 1.0088415769999541
Energy: 1.0846929998150416
Energy: 1.010001170368156
Energy: 1.0092710741998625
Energy: 1.0928322312785779
Energy: 1.1226560716099054
Energy: 1.1054620074507775
Energy: 1.0326484664338298
Energy: 1.0279603257167798
Energy: 1.009182820613419
Energy: 1.0921368039293975
Energy: 1.0652951849214483
Energy: 1.0632926951571642
Energy: 1.104553249202093
Energy: 1.0822864269718178
Energy: 1.0630410954750384
Energy: 1.0240085128587892
Energy: 1.0842627206390398
Energy: 1.082602323632234
Energy: 1.0123261938201964
Energy: 1.1604633116165728
Energy: 1.0841908359043315
Energy: 1.078646195384053
Energy: 1.0312637130706654
Energy: 1.0615463828806908
Energy: 1.0274689136332502
Energy: 1.0839649389065698
Energy: 1.1177222461253171
Energy: 0.9603482116830503
Energy: 1.0276286053615948
Energy: 1.0463674886306757
Energy: 0.9574207116047928
Energy: 1.176698102097313
Energy: 1.0453673968032455

minimum gb energy = 0.9459764271259483 eV
minimum distance =  2.33860962260852 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.3654810456652815
Energy: 1.3299933271473203
Energy: 1.327019607574768
Energy: 1.3674642103884829
Energy: 1.2814859352543575
Energy: 1.2396817783526455
Energy: 1.2332043955400656
Energy: 1.1282714780064529
Energy: 1.129755618624835
Energy: 1.2435171630881163
Energy: 1.247563840657061
Energy: 1.1302453234791159
Energy: 1.3050995081757486
Energy: 1.0112997585467052
Energy: 1.011043592780837
Energy: 1.304986023260573
Energy: 1.0103868733512849
Energy: 1.0101301935710032
Energy: 1.1404305464885274
Energy: 1.0110797342315676
Energy: 1.0184401851321343
Energy: 1.139041844499369
Energy: 0.9482203677796645
Energy: 1.130761697173027
Energy: 1.146475557053306
Energy: 1.1051565364553284
Energy: 0.9428518165030956
Energy: 1.146639442561378
Energy: 1.1860102397990075
Energy: 0.9414973260229165
Energy: 1.1622942243994225
Energy: 0.9659462006176365
Energy: 0.9661461450008553
Energy: 1.1636557023745122
Energy: 0.9844501946652656
Energy: 0.9072241089116742
Energy: 1.2048644120470835
Energy: 0.959832669643494
Energy: 0.9613175946945074
Energy: 1.2041535815882431
Energy: 0.9606900189633777
Energy: 0.9841836676913375
Energy: 1.1447525779923873
Energy: 1.157201218675775
Energy: 1.172709557167307
Energy: 1.147167003707517
Energy: 1.1483068047342129
Energy: 1.1721850324711314
Energy: 0.9845533754079416
Energy: 0.9584583310737075
Energy: 1.0546155849877974
Energy: 0.9843485542834268
Energy: 1.1255129168747005
Energy: 0.9844779353960753
Energy: 0.9844026496739513
Energy: 0.9655679540821988
Energy: 0.9652695029250586
Energy: 0.9842869177976062
Energy: 0.9670414411115122
Energy: 0.9407528692140483
Energy: 1.1853601916181922
Energy: 1.045812105597635
Energy: 1.0889691231445282
Energy: 1.1851568243820294
Energy: 1.1233092157798554
Energy: 1.1066287173122549
Energy: 1.2242135563963032
Energy: 1.1072097362604671
Energy: 1.1302856721302603
Energy: 1.2242695360222535
Energy: 1.1075167710600156
Energy: 1.1291421834461144
Energy: 1.2874750380754545
Energy: 1.2794345352906409
Energy: 1.1909468207528189
Energy: 1.2899331779284262
Energy: 1.3030564545567183
Energy: 1.142248735992314
Energy: 1.2507524603578424
Energy: 1.1065853796286484
Energy: 1.1061554597304168
Energy: 1.2502838909677207
Energy: 1.1805577912201841
Energy: 1.0872486946409365
Energy: 1.255486487406412
Energy: 1.1943774543023618
Energy: 1.1760938465422397
Energy: 1.2553586879185996
Energy: 1.1262381481153818
Energy: 1.1763112888299654
Energy: 1.2845298766243127
Energy: 1.1317643090590415
Energy: 1.2943510768656181
Energy: 1.284676612230757
Energy: 1.14424292472574
Energy: 1.130589974378017
Energy: 1.1535505975524338
Energy: 1.3028450364849626
Energy: 1.2891195319220827
Energy: 1.1543549706344878
Energy: 1.3032003165290416
Energy: 1.2377107562570488

minimum gb energy = 0.9072241089116742 eV
minimum distance =  2.30011320794966 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.4177263470182033
Energy: 1.2284304460333864
Energy: 1.0743709222742848
Energy: 1.4175003727876978
Energy: 1.1805857642738935
Energy: 1.0623766297154476
Energy: 1.2110243222247605
Energy: 1.121932937024548
Energy: 1.1200058416320766
Energy: 1.2199107910549256
Energy: 1.2226017136653484
Energy: 1.1204823072016594
Energy: 1.2436890285488695
Energy: 0.8924961034085381
Energy: 1.0197670009415711
Energy: 1.2452807461935418
Energy: 1.2453028030772464
Energy: 1.020241239823471
Energy: 1.128062471221219
Energy: 1.0201469606276814
Energy: 1.0193321620576388
Energy: 1.121656393703987
Energy: 1.0947578052389435
Energy: 1.0191383632829127
Energy: 1.0617938378444585
Energy: 1.0614541509879523
Energy: 0.9581931757238443
Energy: 1.0617434066377418
Energy: 1.1589042451426765
Energy: 0.9702575348009514
Energy: 1.2118587641612637
Energy: 0.9572216414306222
Energy: 0.8937817143860111
Energy: 1.2175847084723577
Energy: 0.9585883703314919
Energy: 0.8961343912850855
Energy: 1.146344297651323
Energy: 0.9711459000424664
Energy: 0.970621411021142
Energy: 1.0862149292763368
Energy: 0.9746731652745589
Energy: 0.9572449050467834
Energy: 1.0841468549286402
Energy: 0.858770868923226
Energy: 0.8753903610084978
Energy: 1.0870539721843642
Energy: 1.1077975228488066
Energy: 0.8764963448179627
Energy: 0.9054483425996364
Energy: 0.8892487867628298
Energy: 0.9065280583270824
Energy: 0.9067749305642353
Energy: 1.1416777219853356
Energy: 0.9064752566297339
Energy: 0.8715178015233028
Energy: 0.8990892522267991
Energy: 0.9621158419676561
Energy: 0.8713948387239546
Energy: 1.0955276003408858
Energy: 0.9649106150066488
Energy: 1.0840431818420626
Energy: 0.8917339789098424
Energy: 0.9648358349438773
Energy: 1.0833459606678777
Energy: 0.8880126335790098
Energy: 1.0417123665191617
Energy: 1.0161971604323956
Energy: 0.9056009996163537
Energy: 0.9057821216863866
Energy: 1.0170709309290635
Energy: 0.905335466977125
Energy: 0.9054972987009038
Energy: 1.1581005990885165
Energy: 0.9855710676902513
Energy: 0.879546661005538
Energy: 1.1584720446858534
Energy: 1.0843940861209553
Energy: 0.8753274357055101
Energy: 0.9710046167514098
Energy: 0.9832116992989666
Energy: 0.9458380850256932
Energy: 0.9721757873623347
Energy: 1.1328604642176534
Energy: 0.96909840767516
Energy: 0.9697970754083287
Energy: 1.0788621105042624
Energy: 0.9968002853672341
Energy: 0.9697477986862417
Energy: 1.1623895179660237
Energy: 0.9712750964099315
Energy: 1.1579103028552404
Energy: 1.0640246705771248
Energy: 0.9704846667005598
Energy: 1.157613321658323
Energy: 1.0643019784010652
Energy: 0.9690261252412251
Energy: 0.9072351224696781
Energy: 1.1210586169537942
Energy: 1.1211062055821481
Energy: 1.0700980609517576
Energy: 1.1211597984293573
Energy: 0.9677815528905871
Energy: 1.0537325780819702
Energy: 1.2528137897341265
Energy: 1.1451628585421918
Energy: 1.0540147715307147
Energy: 1.2564730339413224
Energy: 0.9539124759722404
Energy: 1.1607319761667991
Energy: 1.1054919303595363
Energy: 1.0600033852334179
Energy: 1.1569373744250249
Energy: 1.1538093105446516
Energy: 1.0490975354320757
Energy: 1.2644949453828898
Energy: 0.9621171214115262
Energy: 0.9571318335089654
Energy: 1.2406411695930235
Energy: 1.3195957915462948
Energy: 1.1159510265732449
Energy: 1.2149888200559755
Energy: 1.104648966482692
Energy: 1.1173259325089853
Energy: 1.2156691967375228
Energy: 1.2216893281857748
Energy: 1.1205968718504136
Energy: 1.4381290446211699
Energy: 1.253155416921126
Energy: 1.2541303382357973
Energy: 1.44071124589158
Energy: 1.2534779017376687
Energy: 1.016888802805478
Energy: 1.1341877524914767
Energy: 1.2186862657459427
Energy: 1.1209902795709592
Energy: 1.094062347709742
Energy: 1.2210056047449216
Energy: 1.2176775056525369
Energy: 1.2098944592361132
Energy: 1.0986508147800385
Energy: 1.1200517502608818
Energy: 1.211423270437629
Energy: 1.1173445853542459
Energy: 1.1198250710458213
Energy: 1.1210259596821965
Energy: 1.0137499700541217
Energy: 1.0204825844309002
Energy: 1.1212071758865065
Energy: 1.2158487258651471
Energy: 1.0210578175499092
Energy: 1.0617819825182069
Energy: 1.0689066324874108
Energy: 0.9564314944173201
Energy: 1.0631316795146375
Energy: 1.1250740745804348
Energy: 0.9569484665018639
Energy: 1.2324169412453712
Energy: 1.1579608164110156
Energy: 0.9575737010570359
Energy: 1.2252965981636414
Energy: 1.1568549012551108
Energy: 0.89558725869318
Energy: 1.0814475018549103
Energy: 0.970425827472933
Energy: 0.9711113593188951
Energy: 1.0815934302120431
Energy: 0.9722944769555977
Energy: 0.9702226634423066
Energy: 1.0873875832504916
Energy: 0.9406188719546745
Energy: 0.9914641590077007
Energy: 1.0884350453169276
Energy: 0.967302005883628
Energy: 0.8790443609372794
Energy: 0.887922238385477
Energy: 0.8572407046256422
Energy: 0.8896195248131228
Energy: 0.8881298543532915
Energy: 1.129258476718823
Energy: 0.8879715778556551
Energy: 0.8765006343380564
Energy: 0.9653185599263164
Energy: 1.0386365902605967
Energy: 0.8768763839365272
Energy: 1.1410939767894641
Energy: 0.9824034867414557
Energy: 1.0839537061753188
Energy: 1.0364108343465952
Energy: 1.0384928749208617
Energy: 1.0859910985750219
Energy: 1.088363575734969
Energy: 1.0358780465737134
Energy: 1.1414577210364465
Energy: 0.9057806851438329
Energy: 0.9059704883582348
Energy: 1.141282310144761
Energy: 0.9066980601490747
Energy: 0.9080714103563617
Energy: 1.160974626625887
Energy: 1.0823606724759243
Energy: 0.9933024032475812
Energy: 1.1615127794498998
Energy: 1.001700709565395
Energy: 1.079347745433825
Energy: 0.9540895871701078
Energy: 0.9840676556475167
Energy: 0.983282270284774
Energy: 0.953524167046366
Energy: 1.084129229676306
Energy: 0.9938629145979896
Energy: 0.9704250843039566
Energy: 0.8753255098346505
Energy: 0.9702009530120786
Energy: 0.9703190937454689
Energy: 1.1816642103251054
Energy: 0.9706979367409315
Energy: 1.1572179588592304
Energy: 0.9682120432462029
Energy: 0.9702545146546074
Energy: 1.1588040112778621
Energy: 1.1068432238483854
Energy: 0.9581447593199368
Energy: 1.159002556752531
Energy: 1.1205866409308838
Energy: 1.1207087658899584
Energy: 1.0601181276931584
Energy: 1.1223042970059147
Energy: 1.120994401947851
Energy: 1.3252555583476286
Energy: 1.2539226886541148
Energy: 0.9582893749566634
Energy: 1.3259724543488187
Energy: 1.2533498682882536
Energy: 0.9595698954920778
Energy: 1.1558051804265828
Energy: 1.1184701323108934
Energy: 1.118437674401622
Energy: 1.155250423027484
Energy: 1.2178081455325067
Energy: 1.1210365958312207
Energy: 1.2213198555003288
Energy: 0.9546682646900917
Energy: 1.1544943251604758
Energy: 1.2208654090059778
Energy: 1.3189608663178607
Energy: 1.154195679294305
Energy: 1.2102004926574437
Energy: 1.0533799321907822
Energy: 1.1161207131899136
Energy: 1.2118607449593766
Energy: 1.1561038972597757
Energy: 1.1203472632838007
Energy: 1.0205740297054051
Energy: 1.2521150269192134
Energy: 1.1206078306816625
Energy: 1.1746912996954266
Energy: 1.2553719593780703
Energy: 1.2173205857360005

minimum gb energy = 0.8572407046256422 eV
minimum distance =  2.28137143012192 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 1.2367745982721725
Energy: 1.2192643474422378
Energy: 1.0460759621580011
Energy: 1.2427978810860085
Energy: 1.1730160492777872
Energy: 1.0429042882177229
Energy: 1.1449913963473803
Energy: 1.0338961580650237
Energy: 1.0331667587528293
Energy: 1.1656372363077485
Energy: 1.1748102189372807
Energy: 0.9393039685520005
Energy: 1.1875111908406346
Energy: 0.8886059345474667
Energy: 0.8854567142101485
Energy: 1.1883292403643422
Energy: 0.8861226557572431
Energy: 0.9932054028267668
Energy: 1.031073331891488
Energy: 0.9067547686512973
Energy: 0.9928214799679219
Energy: 1.0331921095344094
Energy: 1.0355121707657764
Energy: 0.9932082368291457
Energy: 0.9938030430338739
Energy: 1.0476302464972518
Energy: 0.9476338591281316
Energy: 0.9937004574464892
Energy: 1.088573572800673
Energy: 0.9430591383848057
Energy: 1.1231555565647906
Energy: 0.9370212924303769
Energy: 0.8785746964611202
Energy: 1.1257583703140048
Energy: 0.9367242529504298
Energy: 0.8787687271702358
Energy: 1.0362584800845895
Energy: 0.9452654014415811
Energy: 0.9459811043683868
Energy: 1.0361880907618175
Energy: 0.9503885283128274
Energy: 0.9211545464528988
Energy: 1.0412463549176079
Energy: 0.830017365742936
Energy: 0.818635855355539
Energy: 1.0437787096034772
Energy: 0.8297325607528115
Energy: 0.8510194841391232
Energy: 0.8725487297699929
Energy: 0.87477038466756
Energy: 0.8700433119571436
Energy: 0.8743371416673508
Energy: 0.988337782932295
Energy: 0.858624547601583
Energy: 0.8683459646587912
Energy: 0.8954015609253441
Energy: 0.9171130004656414
Energy: 0.8687457920233267
Energy: 1.0160182713040669
Energy: 0.9616853263679235
Energy: 1.0585606969900103
Energy: 0.8131216506377301
Energy: 0.8962431420807263
Energy: 1.0599415514412256
Energy: 0.811804156896761
Energy: 0.8958770829658234
Energy: 1.0461626973023628
Energy: 0.8361876160695898
Energy: 0.8355832629626485
Energy: 1.0684237471656142
Energy: 0.8409704981390814
Energy: 0.9027672096693876
Energy: 1.0311883720404458
Energy: 0.9636199889996455
Energy: 0.9781194995610768
Energy: 1.0345017013392055
Energy: 1.0319727538413415
Energy: 0.9781617267374801
Energy: 0.8366261372548132
Energy: 0.9670484928102243
Energy: 0.8345266660287186
Energy: 0.8396371774819418
Energy: 1.0680590842799378
Energy: 0.8254142565264215
Energy: 0.8097154147256939
Energy: 0.9137005414111626
Energy: 0.9064266858380199
Energy: 0.8096431001190009
Energy: 1.116082461388657
Energy: 0.8985370407754396
Energy: 1.0199981328862293
Energy: 0.8593221005595975
Energy: 1.0015894535898726
Energy: 1.0183705953582414
Energy: 0.8609930470161988
Energy: 0.99916720079003
Energy: 1.1032902887699623
Energy: 0.8694505418115555
Energy: 0.8601118557509896
Energy: 1.1032832455064396
Energy: 0.8691476008185042
Energy: 0.8690092662102954
Energy: 0.9446798288600473
Energy: 0.9444803910412298
Energy: 0.8501284874449104
Energy: 0.9445284483842683
Energy: 1.041090009742366
Energy: 0.8639174249766884
Energy: 0.9447698780203166
Energy: 0.8384954001667331
Energy: 0.9445057124241598
Energy: 0.9476350579100414
Energy: 1.0400413551234735
Energy: 0.9452355431985137
Energy: 1.0979779778178864
Energy: 0.9549927386948055
Energy: 0.9567077740258397
Energy: 1.098109707619588
Energy: 1.1996642883373465
Energy: 0.9422142282561036
Energy: 1.0951813405176538
Energy: 1.032109527391799
Energy: 0.942125294142715
Energy: 1.0951133834905191
Energy: 1.0338772761315673
Energy: 0.943689122119693
Energy: 1.1934988819024963
Energy: 1.0872216578754064
Energy: 0.9450486310235156
Energy: 1.1963586486746567
Energy: 1.0871275061214523
Energy: 0.9483329368373687
Energy: 1.026153292372743
Energy: 1.1930407512356669
Energy: 1.0840371400421527
Energy: 1.0251039746228476
Energy: 1.1852966014400341
Energy: 1.0844134307303595
Energy: 1.114335513139998
Energy: 0.9592707961054479
Energy: 1.0310809789349642
Energy: 1.1159917268694441
Energy: 1.1142287267982856
Energy: 1.0368843309069475
Energy: 1.184371652606541
Energy: 0.9403741394072219
Energy: 0.9405004032371463
Energy: 1.1842346590155184
Energy: 1.152901887997955
Energy: 1.0882011695543754
Energy: 1.1993099707547838
Energy: 1.0848698404427177
Energy: 1.0840011172160986
Energy: 1.170822274022558
Energy: 1.1699162665388512
Energy: 1.0851151269584192
Energy: 1.248207570478105
Energy: 1.1935034400481772
Energy: 0.9952275638499488
Energy: 1.2441005097247382
Energy: 1.1963566343746626
Energy: 0.9955596470709317

minimum gb energy = 0.8096431001190009 eV
minimum distance =  2.29126195228768 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 1.1055366331192986
Energy: 1.0957061602187237
Energy: 0.9579278138972033
Energy: 1.1088557943084665
Energy: 1.0285718146243572
Energy: 0.8611413531654866
Energy: 0.9703155498514218
Energy: 0.9511557399965394
Energy: 0.8471368338027551
Energy: 0.928385792926176
Energy: 0.9533518366503995
Energy: 0.9136783019939145
Energy: 1.017092401981949
Energy: 0.7422000582353248
Energy: 0.7757698154401337
Energy: 1.0141423950055264
Energy: 0.7919411958400842
Energy: 0.8043954477293794
Energy: 0.9264267376972067
Energy: 0.8282374895749118
Energy: 0.7947308278761736
Energy: 0.9271949614458498
Energy: 0.9056262757537084
Energy: 0.8955525888718187
Energy: 0.92318221570643
Energy: 0.921525358184375
Energy: 0.8471781931805493
Energy: 0.9211039970864775
Energy: 0.9514710417589831
Energy: 0.8290713460370771
Energy: 1.0287489407692814
Energy: 0.8591275601174185
Energy: 0.8104547004789946
Energy: 1.0317919061107368
Energy: 0.8596501834042812
Energy: 0.7455249548630152
Energy: 0.9242606017424223
Energy: 0.8559654553113771
Energy: 0.8557723021286907
Energy: 0.9242247169578341
Energy: 0.8554429222866181
Energy: 0.9028873561983513
Energy: 0.933636611720081
Energy: 0.7138781713849888
Energy: 0.727658816518619
Energy: 0.9296704358000087
Energy: 0.7550046526349693
Energy: 0.737205954365624
Energy: 0.789267979329831
Energy: 0.7405844022550251
Energy: 0.7873080940612421
Energy: 0.7893835478531077
Energy: 0.8662448085937113
Energy: 0.7871874702223222
Energy: 0.7857969828290707
Energy: 0.7796893301781016
Energy: 0.7938637161541331
Energy: 0.7858020810450093
Energy: 0.8957191799847256
Energy: 0.7972039727311071
Energy: 0.9758918478530294
Energy: 0.7264012907040366
Energy: 0.7407852289699787
Energy: 0.9738823175784439
Energy: 0.7335087391893478
Energy: 0.7207145124669083
Energy: 0.8823140946518934
Energy: 0.7430443630765915
Energy: 0.7423191579478665
Energy: 0.8830219687203104
Energy: 0.7426155305386554
Energy: 0.8316496278519634
Energy: 0.8889734715092017
Energy: 0.8263305280721308
Energy: 0.8381503767814535
Energy: 0.8871844983531085
Energy: 0.8315049981957288
Energy: 0.83312070583896
Energy: 0.7148606276230988
Energy: 0.8836534266344049
Energy: 0.7154748963286395
Energy: 0.7150631778495715
Energy: 0.9059933352511633
Energy: 0.7143348725408383
Energy: 0.8042103404879135
Energy: 0.79392346833022
Energy: 0.8062170152375041
Energy: 0.8032549806978886
Energy: 0.8943784265871016
Energy: 0.7951548862892911
Energy: 0.9401966004342305
Energy: 0.7018031498604078
Energy: 0.6985046194243645
Energy: 0.905386741883198
Energy: 0.7018306391240688
Energy: 0.8215783020140339
Energy: 0.9383427787268628
Energy: 0.7029788613711435
Energy: 0.7029939503384673
Energy: 0.9152957814317477
Energy: 0.7031373655094638
Energy: 0.7892149043530563
Energy: 0.8964286172673293
Energy: 0.798240401176915
Energy: 0.8130432331611309
Energy: 0.8910765897564319
Energy: 0.9181808562705615
Energy: 0.8229327994397218
Energy: 0.7040476054090336
Energy: 0.9124692218540812
Energy: 0.7031850715503565
Energy: 0.7050541684763284
Energy: 0.9054471232761534
Energy: 0.7024552297171961
Energy: 0.8938233477126398
Energy: 0.8071066619456108
Energy: 0.8058303924637346
Energy: 0.8950988217449196
Energy: 0.9710224881663434
Energy: 0.8214596006854101
Energy: 0.8913909223512734
Energy: 0.7158644590294223
Energy: 0.7129200451380432
Energy: 0.8930127382925939
Energy: 0.7155345963429728
Energy: 0.800271610272917
Energy: 1.0210133521141174
Energy: 0.7047163948585835
Energy: 0.7134987945090548
Energy: 0.8158548783843909
Energy: 0.7118721419603008
Energy: 0.8135593689618955
Energy: 0.8285483278602158
Energy: 0.8529866938171133
Energy: 0.8228387379906239
Energy: 0.7443666243125203
Energy: 0.8848282589092297
Energy: 0.8036205983977137
Energy: 0.741461058503214
Energy: 0.9193269011706544
Energy: 0.7402612562088768
Energy: 0.7441261206254277
Energy: 0.9078524018446502
Energy: 0.7401153510932379
Energy: 0.8953923654609743
Energy: 0.8419378497939372
Energy: 0.7295686493381659
Energy: 0.8934876660319366
Energy: 0.8399835229058371
Energy: 0.8024041865546145
Energy: 0.890916253824496
Energy: 0.7860030629740411
Energy: 0.7857755143979869
Energy: 0.8909861377077508
Energy: 0.786692408139026
Energy: 0.8788044691283765
Energy: 1.0047021885381489
Energy: 0.780660979037169
Energy: 0.786885595347237
Energy: 1.0031442325355266
Energy: 0.7866312106087086
Energy: 0.8003614485565937
Energy: 0.8281818463052745
Energy: 0.8497907798997568
Energy: 0.7699225252078679
Energy: 0.8566282207170485
Energy: 0.9301835451327943
Energy: 0.7371161537061516
Energy: 0.8592133834176956
Energy: 0.7631688115953342
Energy: 0.8586852231146046
Energy: 0.8590890279775513
Energy: 0.9078389840823726
Energy: 0.8561363827020272
Energy: 0.9828214312885508
Energy: 0.7798298054545314
Energy: 0.759867894431465
Energy: 0.9634093885815574
Energy: 0.764781412048319
Energy: 0.7823812243412294
Energy: 0.9497623587053254
Energy: 0.9254381605149531
Energy: 0.8466939164995574
Energy: 0.9495790802500259
Energy: 0.9254728932497687
Energy: 0.8248167201407655
Energy: 1.0673397515879122
Energy: 0.9673584159610937
Energy: 0.855989834950598
Energy: 1.0698930150201926
Energy: 0.9670225018574594
Energy: 0.769848983484964
Energy: 0.9233031878182009
Energy: 0.9492664508283856
Energy: 0.9639743277991495
Energy: 0.923041328132118
Energy: 0.980870819627431
Energy: 0.9634921738963385
Energy: 0.9857958421565336
Energy: 0.84891305937085
Energy: 0.855475958151741
Energy: 0.988025339630026
Energy: 0.9250460231162649
Energy: 0.9850793429353197
Energy: 1.0359621961696255
Energy: 0.8240687923455644
Energy: 0.8384373550365111
Energy: 1.0339566143573167
Energy: 0.8275130051669369
Energy: 0.8470835548622597
Energy: 0.9408955014418868
Energy: 0.9907853607569123
Energy: 0.9639217667500429
Energy: 0.9413338070180614
Energy: 1.0134012689203369
Energy: 0.9655307980359169

minimum gb energy = 0.6985046194243645 eV
minimum distance =  2.2712929652036 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.03166895621488955
Energy: 0.09140344629531634
Energy: 0.032481837260538264
Energy: 0.03457821470223527
Energy: 0.034539959795927326
Energy: 0.03231802322943767
Energy: 0.2610366527611876
Energy: 0.035041872755194756
Energy: 0.03519085624555373
Energy: 0.09300379920184153
Energy: 0.03473698529478523
Energy: 0.035247078115079024
Energy: 0.26481846963615197
Energy: 0.03247130547937053
Energy: 0.03302364216571551
Energy: 0.2648527188125651
Energy: 0.03222477186751319
Energy: 0.09206228449238185
Energy: 0.03603759882197973
Energy: 0.03274307817160603
Energy: 0.03228499192062968
Energy: 0.03441482314441165
Energy: 0.0322865819760351
Energy: 0.09377910921473293
Energy: 0.09222362767215686
Energy: 0.2648723600072094
Energy: 0.2642964869764503
Energy: 0.09356560096464596
Energy: 0.26970013666167797
Energy: 0.0928627030773579
Energy: 0.03347208737787461
Energy: 0.03511965363865547
Energy: 0.03211471801351762
Energy: 0.03197344434794291
Energy: 0.03541685978237417
Energy: 0.03248067681317
Energy: 0.264905298509734
Energy: 0.035062393110973644
Energy: 0.035399711728232704
Energy: 0.2645070162661851
Energy: 0.03471802573596387
Energy: 0.035444023485528345
Energy: 0.26473306315257195
Energy: 0.03237859956388949
Energy: 0.03252652045341693
Energy: 0.2647837190909055
Energy: 0.032160883115036815
Energy: 0.09294988813333722
Energy: 0.036287634990855674
Energy: 0.0328716532792762
Energy: 0.09217336757756024
Energy: 0.035633693158206935
Energy: 0.03278840434473251
Energy: 0.09119691770466376
Energy: 0.03190399359296719
Energy: 0.26485402993703033
Energy: 0.2646666989517693
Energy: 0.03227847683636908
Energy: 0.2693715766730633
Energy: 0.09302466920108737

minimum gb energy = 0.03166895621488955 eV
minimum distance =  2.46528123928582 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 1.1853559480182232
Energy: 0.9927003373902966
Energy: 0.9719218830790257
Energy: 1.1888343167065705
Energy: 1.0370969485166368
Energy: 0.8536244652558345
Energy: 0.9276667483357571
Energy: 0.9710515792909626
Energy: 0.9732578297615345
Energy: 0.9497336444536847
Energy: 0.9567631593641586
Energy: 0.9591582716169584
Energy: 1.0077465435514656
Energy: 0.8781046103826716
Energy: 0.8802355947119944
Energy: 1.0082364818567233
Energy: 0.8863607428288952
Energy: 0.9283036667717823
Energy: 0.9756877998511898
Energy: 0.8712958216011903
Energy: 0.8785959320942911
Energy: 0.9101372395699282
Energy: 0.8386221363494457
Energy: 0.9500451499949055
Energy: 0.8371286739264842
Energy: 0.9411927198591541
Energy: 0.9405092752036935
Energy: 0.8369542292048736
Energy: 0.9442044275534237
Energy: 0.9541554574629683
Energy: 1.1221406092654718
Energy: 0.9490949768162021
Energy: 0.8859088848699455
Energy: 1.123880645265718
Energy: 0.9490880617775848
Energy: 0.8778217326270992
Energy: 0.8688176551046739
Energy: 0.8413796443606718
Energy: 0.8013936194170118
Energy: 0.8774297979007846
Energy: 0.8412906658533801
Energy: 0.8726413906614493
Energy: 0.9745176824483863
Energy: 0.8850188764437593
Energy: 0.884647632146872
Energy: 0.9745425294716445
Energy: 0.9434362441049174
Energy: 0.8305686165437701
Energy: 0.8755141274070563
Energy: 0.8620779936512468
Energy: 0.8605234447030397
Energy: 0.8653544548895875
Energy: 0.7637990927288347
Energy: 0.8605119527253385
Energy: 0.7615801808839171
Energy: 0.833276435324835
Energy: 0.8428614398305747
Energy: 0.7620237571030019
Energy: 0.8401286366691115
Energy: 0.8113940232845009
Energy: 1.0244916199237855
Energy: 0.8962579349971289
Energy: 0.8959240852417848
Energy: 1.0180002954198024
Energy: 0.8874065841810495
Energy: 0.8767253573959705
Energy: 0.7832469058136717
Energy: 0.868616621603271
Energy: 0.898811719633176
Energy: 0.7862360770752682
Energy: 0.8757811938350073
Energy: 0.7376651467426181
Energy: 0.7855670088802759
Energy: 0.8513686998147095
Energy: 0.8820641654528124
Energy: 0.7859963819225811
Energy: 0.9463633166148924
Energy: 0.889223120410541
Energy: 0.8583389350879959
Energy: 0.7202047235984862
Energy: 0.8597460218343952
Energy: 0.860484739831704
Energy: 0.7231695960124704
Energy: 0.8533030453167548
Energy: 0.8346344378656441
Energy: 0.7402362701377968
Energy: 0.7399686699748536
Energy: 0.825116935672677
Energy: 0.7411822802653719
Energy: 0.741996014076648
Energy: 0.8564358785094068
Energy: 0.8609851959076049
Energy: 0.8582993153736315
Energy: 0.8295077161408678
Energy: 0.8299937484052876
Energy: 0.8543031693076013
Energy: 0.720308304830755
Energy: 0.8458095808714525
Energy: 0.8545672070232602
Energy: 0.7217702941780745
Energy: 0.8332227616021572
Energy: 0.7195124334947409
Energy: 0.7059466480533972
Energy: 0.8384647690094124
Energy: 0.8379899377283699
Energy: 0.7057973093443882
Energy: 0.8886990312474798
Energy: 0.8427982626524977
Energy: 0.9088799337586545
Energy: 0.8307009875093412
Energy: 0.8435148118132056
Energy: 0.9016918801780078
Energy: 0.8321118060021554
Energy: 0.8418689724812166
Energy: 0.8112176050563144
Energy: 0.7195705144394464
Energy: 0.7207939416478876
Energy: 0.8135483943965204
Energy: 0.7235760054355801
Energy: 0.72108260619785
Energy: 0.8612795463371462
Energy: 0.8572254141555317
Energy: 0.8590133198296231
Energy: 0.8207215144104086
Energy: 0.840850915425366
Energy: 0.8520715093049553
Energy: 0.739944642200446
Energy: 0.8596385430517606
Energy: 0.8638833811143914
Energy: 0.7411785706861915
Energy: 0.8344300394250244
Energy: 0.739359201108371
Energy: 0.7115772502080978
Energy: 0.8307379510927952
Energy: 0.8590608525766567
Energy: 0.7104988233903367
Energy: 0.8568533515147162
Energy: 0.8479993507536531
Energy: 0.9875545261122836
Energy: 0.7642018168065686
Energy: 0.7557323391582651
Energy: 0.9840692595612138
Energy: 0.76364942498566
Energy: 0.8638985808445525
Energy: 0.810710216191387
Energy: 0.7586428951957868
Energy: 0.7375188829034924
Energy: 0.8107790811039393
Energy: 0.770293129980861
Energy: 0.7602136760771402
Energy: 0.8860223652551393
Energy: 0.8936182518416533
Energy: 0.8936119643240839
Energy: 0.855293271919903
Energy: 0.8645922055136182
Energy: 0.8962599382041403
Energy: 0.8588914419172887
Energy: 0.8964837434400938
Energy: 0.8938899424538892
Energy: 0.858226895447265
Energy: 0.8077135741251633
Energy: 0.8562506983048902
Energy: 0.8120815267784828
Energy: 0.820217868755533
Energy: 0.8175172865625981
Energy: 0.8119226762980295
Energy: 0.8012683871759658
Energy: 0.7954824784001636
Energy: 1.0664855215070965
Energy: 0.9273639558621725
Energy: 0.8781723406045947
Energy: 1.068887844770799
Energy: 0.9253769042028506
Energy: 0.8312831260960332
Energy: 0.8050488912543039
Energy: 0.9158169154991068
Energy: 0.868419171396934
Energy: 0.8045190576399553
Energy: 0.9150234036636895
Energy: 0.8883878383886242
Energy: 0.928317127057556
Energy: 0.879395236737524
Energy: 0.8777909577901537
Energy: 0.9283937109839095
Energy: 0.976270328126644
Energy: 0.9147560048803642
Energy: 0.9576895197972675
Energy: 0.8811864648913273
Energy: 0.8844882495252396
Energy: 0.9466979044327248
Energy: 0.7906444814043009
Energy: 0.8672413971119817
Energy: 0.8779793186569876
Energy: 0.9449386943787154
Energy: 0.8989387593155611
Energy: 0.8802457608480079
Energy: 0.9832446973281784
Energy: 0.9015463252349597

minimum gb energy = 0.7057973093443882 eV
minimum distance =  2.28217374375165 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.2154230701769284
Energy: 1.2021385861200002
Energy: 1.08711359812505
Energy: 1.2160302436198611
Energy: 1.160140313258998
Energy: 1.0784000345287954
Energy: 0.9949224957479875
Energy: 1.0932416083038146
Energy: 1.0821199123385525
Energy: 1.0649744484814634
Energy: 1.089102509113868
Energy: 1.0814072980031022
Energy: 1.132274891288933
Energy: 1.0294433553106508
Energy: 1.0746447479386088
Energy: 1.1330846177283036
Energy: 1.0379938824298238
Energy: 1.0444187805263223
Energy: 1.0736850231364017
Energy: 1.084424221937775
Energy: 1.0758662370494216
Energy: 1.0764973155539412
Energy: 0.990102943333938
Energy: 1.068167892250044
Energy: 0.9679462931968936
Energy: 1.1044661041316028
Energy: 1.0866839144590235
Energy: 0.9771550424166955
Energy: 1.0873903145694672
Energy: 1.0664365603855694
Energy: 1.1382582708488576
Energy: 1.1047104958788998
Energy: 1.0295074665293673
Energy: 1.3082076716753384
Energy: 1.104873876676346
Energy: 0.9803477243211228
Energy: 1.017878725692048
Energy: 0.9142523678707655
Energy: 0.9786953284054222
Energy: 0.9737724690816183
Energy: 0.9132450979430866
Energy: 0.9781985061367892
Energy: 1.0737924408707342
Energy: 1.0306595016064453
Energy: 0.9934244230899065
Energy: 1.0749445691998407
Energy: 1.0613072474187446
Energy: 0.991783296528225
Energy: 1.0475068121585875
Energy: 0.9749113792946523
Energy: 0.9651137197711773
Energy: 1.0439869292855097
Energy: 0.8873441868554574
Energy: 0.9786038548148338
Energy: 0.8662241049794731
Energy: 0.9421730602437022
Energy: 0.941622436555675
Energy: 0.8666167663356121
Energy: 0.9462833591647156
Energy: 0.9429854906164216
Energy: 1.1385946871603565
Energy: 1.0165159302085864
Energy: 1.0339844454322034
Energy: 0.9823604515040222
Energy: 1.001923983770151
Energy: 1.0317749559946419
Energy: 0.879515802289659
Energy: 0.9963360206566886
Energy: 1.0304582653641747
Energy: 0.8627950092611155
Energy: 0.9964399945379373
Energy: 0.8599852467938238
Energy: 0.8764208881966088
Energy: 1.007876089499098
Energy: 1.0124161718312976
Energy: 0.8773262868857928
Energy: 1.0345683652647242
Energy: 0.8618326018895004
Energy: 1.0401491771206361
Energy: 0.996533703077553
Energy: 1.0152600533565903
Energy: 1.0198860729491546
Energy: 0.9935260251744246
Energy: 1.0141945201611027
Energy: 0.9756844092867734
Energy: 0.8814969062003201
Energy: 0.8839838643036224
Energy: 0.9771086825599741
Energy: 0.8831967386633842
Energy: 0.8837992588814152
Energy: 0.9998361218976183
Energy: 1.0380743327439512
Energy: 0.9738723064986422
Energy: 0.9966506616850713
Energy: 0.9504371816749557
Energy: 1.0161186491957404
Energy: 0.938284365943849
Energy: 1.017696439986567
Energy: 1.0137890295824057
Energy: 0.9352070665365843
Energy: 1.032959178438429
Energy: 0.933633438891225
Energy: 0.9429967105751897
Energy: 1.0061133834632787
Energy: 0.9901139157464439
Energy: 0.9129980081470778
Energy: 0.9477041238538984
Energy: 1.005791923449787
Energy: 1.074960267368778
Energy: 1.0323893857060296
Energy: 0.9574543266590118
Energy: 1.2022257715792624
Energy: 1.0458093133000965
Energy: 0.9562878503868597
Energy: 0.9940849959582958
Energy: 0.9675120666724415
Energy: 0.9677542600685951
Energy: 0.992796610135689
Energy: 0.9905839097020981
Energy: 0.974814575131497
Energy: 1.0424187894182924
Energy: 1.0561866599154206
Energy: 1.0517244268877408
Energy: 1.0452002462988192
Energy: 0.9494083748790402
Energy: 1.022564692175678
Energy: 1.1567097556049932
Energy: 1.047701442211272
Energy: 1.0522552973060013
Energy: 1.1893645580619607
Energy: 1.0590520137785362
Energy: 1.0229126568432167
Energy: 0.9950700977983595
Energy: 0.9918911897483863
Energy: 0.9892994127869834
Energy: 1.0821033484409266
Energy: 0.9942917026726942
Energy: 0.9897564072166097

minimum gb energy = 0.8599852467938238 eV
minimum distance =  2.28294573492137 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.4183935338388998
Energy: 1.3202963057862287
Energy: 1.318782510813377
Energy: 1.4142600443231208
Energy: 1.3575927313270333
Energy: 1.139738932410467
Energy: 1.1761885299164447
Energy: 1.1847561460982095
Energy: 1.0377288910189768
Energy: 1.166295520338628
Energy: 1.1649934116686016
Energy: 1.0375725428658713
Energy: 1.16051899950277
Energy: 1.0206338297781898
Energy: 1.148698407895967
Energy: 1.1614141928970227
Energy: 1.1312485864973887
Energy: 1.1519116251978725
Energy: 1.0459283692935397
Energy: 1.0198718970533767
Energy: 1.1309292365021701
Energy: 1.0471054167224123
Energy: 1.0076876960532295
Energy: 1.1306236543768948
Energy: 1.0725426881003646
Energy: 1.1669315667873557
Energy: 1.1664923126867517
Energy: 1.0726848309443744
Energy: 1.2054640499393785
Energy: 1.1411824555526322
Energy: 1.2687600316446679
Energy: 1.2003152196791596
Energy: 1.1994880309372664
Energy: 1.270554887417962
Energy: 1.200783055462848
Energy: 1.1111056508589798
Energy: 1.0699150323730935
Energy: 1.0294412418961911
Energy: 1.0295001209000516
Energy: 1.0705568595839083
Energy: 1.0288543635731722
Energy: 1.032455950411435
Energy: 1.1030823032690522
Energy: 1.0375468576892792
Energy: 1.036305051406916
Energy: 1.0699021943118967
Energy: 1.0237954996428198
Energy: 1.0608046477161612
Energy: 1.083870607049065
Energy: 1.0226878377909896
Energy: 1.0329475691519538
Energy: 1.0845521958727857
Energy: 0.9568473955145347
Energy: 1.118196450642321
Energy: 1.0776610149828667
Energy: 0.9783463094700192
Energy: 0.9761194658546962
Energy: 1.0785578955150126
Energy: 0.9833244629863855
Energy: 0.9794840166473725
Energy: 1.127546124009853
Energy: 1.0096180893747364
Energy: 1.1285980180886133
Energy: 1.1201238380110061
Energy: 1.0099538897524423
Energy: 1.1283375704849743
Energy: 0.9799973661460221
Energy: 1.117843221864957
Energy: 0.9560939598408623
Energy: 0.9787351320643066
Energy: 1.0726597868945458
Energy: 0.9790321159893468
Energy: 0.9581551074253276
Energy: 1.0696722936027367
Energy: 1.1157081673875007
Energy: 0.9562082608707076
Energy: 1.0732536192819795
Energy: 0.958240280600374
Energy: 1.1650798619553666
Energy: 1.0925461411789221
Energy: 1.1255594740465402
Energy: 1.1653424181751393
Energy: 1.0946356974066493
Energy: 1.0389126197860161
Energy: 1.018277692506843
Energy: 1.0594728074866908
Energy: 1.059585838780825
Energy: 1.0184368095689311
Energy: 1.058708064539046
Energy: 1.0417266600923167
Energy: 1.0209428840394361
Energy: 1.0780652558000496
Energy: 1.0787517378775553
Energy: 1.0216623745628377
Energy: 0.9637357103368689
Energy: 1.0207664642104854
Energy: 1.160601844840266
Energy: 1.094588204725959
Energy: 1.0943872076699803
Energy: 1.160838292879644
Energy: 1.0775280307228918
Energy: 1.0933280466723345
Energy: 1.2183992629980394
Energy: 1.0362990567022299
Energy: 1.0370594770358397
Energy: 1.2180792765580077
Energy: 1.0359577722092324
Energy: 1.1084847562409024
Energy: 1.3810232422756323
Energy: 1.203452827248172
Energy: 1.2188327119908717
Energy: 1.382372123476132
Energy: 1.2034831198507183
Energy: 1.0919729346707387
Energy: 1.10592562797715
Energy: 1.181543682837549
Energy: 1.1835662588111253
Energy: 1.1941272984582962
Energy: 1.180560661116784
Energy: 1.1571563425223623
Energy: 1.179842466436109
Energy: 1.0199892950721066
Energy: 1.0349875312754984
Energy: 1.1603143058121432
Energy: 1.1246013874228467
Energy: 1.1516496219088448
Energy: 1.167933318948856
Energy: 1.0192596085625392
Energy: 1.1314521124419596
Energy: 1.1536174731615207
Energy: 1.1318999794435092
Energy: 1.1303120453825155
Energy: 1.072727391515855
Energy: 1.1804942593161234
Energy: 1.037381093160813
Energy: 1.0734922033317802
Energy: 1.1847294633964118
Energy: 1.034458820543061
Energy: 1.2990891720786526
Energy: 1.2008489446413293
Energy: 1.200805005636343
Energy: 1.2637064038811878
Energy: 1.2011752007802536
Energy: 1.089020171923435
Energy: 1.0701498254807726
Energy: 1.0307366952039665
Energy: 1.0297315006473473
Energy: 1.0704445980918906
Energy: 1.0293582296201578
Energy: 1.1386193802857745
Energy: 1.104328390038203
Energy: 1.0231539987179157
Energy: 1.0374193824286515
Energy: 1.1045173217376725
Energy: 1.03801171411826
Energy: 1.0602542232802878
Energy: 1.105127431434057
Energy: 1.0226020785557606
Energy: 1.0224940155519928
Energy: 1.103849783608425
Energy: 0.9548885196096706
Energy: 1.1048827572717175
Energy: 1.0764630247633156
Energy: 0.9790801916911432
Energy: 0.9779448743669142
Energy: 1.07891031501227
Energy: 0.9824918963360476
Energy: 0.9791867177293995
Energy: 1.1294627769498384
Energy: 1.0099582005925243
Energy: 1.1281728074535615
Energy: 1.13162754319108
Energy: 1.010118592117119
Energy: 1.1302845065879774
Energy: 0.9783901317489553
Energy: 1.1186782109468423
Energy: 1.0626315115005203
Energy: 0.9785158339526999
Energy: 1.0657676112268433
Energy: 1.0759749248576163
Energy: 0.9579415286922818
Energy: 1.0698722562699634
Energy: 1.1171487595202083
Energy: 0.9585506275619297
Energy: 1.0730891018056072
Energy: 0.9789981975766275
Energy: 1.1479142253143515
Energy: 1.1198687987003468
Energy: 1.104224751346472
Energy: 1.1270881281180927
Energy: 1.0953396956914785
Energy: 1.0398322055653497
Energy: 1.0795594683758127
Energy: 1.0614358333405158
Energy: 1.0605242950241027
Energy: 1.0796720651177911
Energy: 1.09612407632395
Energy: 1.062090946517014
Energy: 1.0620744848688037
Energy: 1.0674237437346052
Energy: 1.031636228738947
Energy: 1.0309610050960418
Energy: 0.9610688770311441
Energy: 1.0213173361061494
Energy: 1.160898683362092
Energy: 1.093426880280693
Energy: 1.094774953239076
Energy: 1.160342054588655
Energy: 1.1628067213189215
Energy: 1.1180564299521576
Energy: 1.2182822493225511
Energy: 1.0360340795226024
Energy: 1.0362015132613651
Energy: 1.218176580887572
Energy: 1.0357368616432325
Energy: 1.1619878403320705
Energy: 1.3780146307096015
Energy: 1.2067796422159247
Energy: 1.2233966449351061
Energy: 1.3803671445964019
Energy: 1.2054815283726013
Energy: 1.0915790646629087

minimum gb energy = 0.9548885196096706 eV
minimum distance =  2.28461066337986 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.2897667513924274
Energy: 1.3225659299732824
Energy: 1.3177231949155812
Energy: 1.2904717355426032
Energy: 1.2842325875674832
Energy: 1.3904208089146077
Energy: 1.1005474295470679
Energy: 1.181919797183106
Energy: 1.1871328451664893
Energy: 1.208257269212564
Energy: 1.1765663042966832
Energy: 1.2402990581128264
Energy: 1.2272179831339907
Energy: 1.2441329635007805
Energy: 1.1840774366605435
Energy: 1.227696096278182
Energy: 1.2803157903373799
Energy: 1.2212220999003573
Energy: 1.258777630751238
Energy: 1.1773631722051385
Energy: 1.176792569037915
Energy: 1.2605123714573245
Energy: 1.446759543882579
Energy: 1.227155864043792
Energy: 1.0698050427895844
Energy: 1.22399899716294
Energy: 1.2234536319399731
Energy: 1.0703856138070629
Energy: 1.2265627106698145
Energy: 1.179801639785293
Energy: 1.1974351529146696
Energy: 1.2451437264552059
Energy: 1.2200584095304872
Energy: 1.1988837012752724
Energy: 1.24315816529868
Energy: 1.2026598040229635
Energy: 1.1136775156800613
Energy: 1.1758035121611778
Energy: 1.1745201627038189
Energy: 1.1138590188825075
Energy: 1.1759501805036037
Energy: 1.1152091117606524
Energy: 1.0927716473661906
Energy: 1.2110330504634435
Energy: 1.0700560069177285
Energy: 1.0939200081401963
Energy: 1.1948741955401387
Energy: 1.1152144784415454
Energy: 1.1409966462198693
Energy: 1.1943219374121767
Energy: 1.2231605164296946
Energy: 1.1445241744747832
Energy: 1.1005218345220944
Energy: 1.1692059468169917
Energy: 1.1123929588020118
Energy: 1.12319394834402
Energy: 1.1128644661463576
Energy: 1.1112426604721526
Energy: 1.116598112700602
Energy: 1.1148700040249275
Energy: 1.1434777360549822
Energy: 1.069863291079272
Energy: 1.1741189047064802
Energy: 1.1420699057040515
Energy: 1.1181602732999891
Energy: 1.1751059664893082
Energy: 1.2483130329100223
Energy: 1.162615860115247
Energy: 1.1627500826997526
Energy: 1.2497094755282514
Energy: 1.3228247399414712
Energy: 1.1283522425661097
Energy: 1.2233014161708577
Energy: 1.188584221394388
Energy: 1.1870937343513468
Energy: 1.223979646085275
Energy: 1.1901916149005267
Energy: 1.2404355992287739
Energy: 1.3139239630724422
Energy: 1.2469921209819756
Energy: 1.3026408181014868
Energy: 1.2593165345980901
Energy: 1.2464393675197638
Energy: 1.2955663316778412

minimum gb energy = 1.0698050427895844 eV
minimum distance =  2.31235503387406 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.2554605356906017
Energy: 1.1946405049248143
Energy: 1.2273582347151875
Energy: 1.25554606237518
Energy: 1.2313862748921125
Energy: 1.3543474834675373
Energy: 1.1914643218711842
Energy: 1.1570570631114434
Energy: 1.1789533284037164
Energy: 1.2789320818118064
Energy: 1.156966264817833
Energy: 1.1764949614237648
Energy: 1.3527124217669677
Energy: 1.2624185757043918
Energy: 1.1891758740993714
Energy: 1.2560921717236784
Energy: 1.2847811745615136
Energy: 1.228069757974937
Energy: 1.2233886508083616
Energy: 1.2754075596268102
Energy: 1.2445255814971206
Energy: 1.2239104134456666
Energy: 1.1721201390723623
Energy: 1.2407068120791505
Energy: 1.205197385157305
Energy: 1.1575591020018237
Energy: 1.1799361874560361
Energy: 1.205971529799987
Energy: 1.1577224136745665
Energy: 1.1953122070486393
Energy: 1.289508654801599
Energy: 1.18562348078561
Energy: 1.185154424125928
Energy: 1.2053160006947636
Energy: 1.1824244218040088
Energy: 1.1599702503149034
Energy: 1.1603016774590706
Energy: 1.1586556868494324
Energy: 1.2285753531685306
Energy: 1.160119639045402
Energy: 1.2231666778553663
Energy: 1.1867564080717519
Energy: 1.1569437714217952
Energy: 1.207207285227725
Energy: 1.2177831382739215
Energy: 1.1569574075510325
Energy: 1.207160082362089
Energy: 1.1800679862057308
Energy: 1.2116522577850488
Energy: 1.2240713853112064
Energy: 1.1950123431543782
Energy: 1.209783889065776
Energy: 1.2225294506458966
Energy: 1.2347895685957186
Energy: 1.217036229508542
Energy: 1.2504686405529106
Energy: 1.270424225195577
Energy: 1.2094461277240285
Energy: 1.2496983992622
Energy: 1.2349833775324106
Energy: 1.157204283668625
Energy: 1.1928600734330839
Energy: 1.2401455167233937
Energy: 1.157399911858366
Energy: 1.1675862212193222
Energy: 1.1801265195994821
Energy: 1.178003863242717
Energy: 1.2131959651856377
Energy: 1.2120759034399184
Energy: 1.178192975217897
Energy: 1.5050491200287839
Energy: 1.2761934673857283
Energy: 1.1687741203525752
Energy: 1.2708617072562716
Energy: 1.2087999401197098
Energy: 1.1685912850726898
Energy: 1.2792701883888475
Energy: 1.1786708893243967
Energy: 1.1943361947576472
Energy: 1.3144104246255963
Energy: 1.3947060050111633
Energy: 1.2077960987802658
Energy: 1.3600115541034703
Energy: 1.2519869949358413
Energy: 1.1727980116707597
Energy: 1.1700683179139681
Energy: 1.2078048523596556
Energy: 1.1727651564973813
Energy: 1.246448101104263
Energy: 1.2077213430091571
Energy: 1.1700188626006045
Energy: 1.1651633566119894
Energy: 1.2148443881258246
Energy: 1.1718082030763235
Energy: 1.1717466579401148
Energy: 1.169939712462228
Energy: 1.174674081969341
Energy: 1.1675635852734199
Energy: 1.1675860581351776
Energy: 1.1747962409458563
Energy: 1.2420576932685996
Energy: 1.2167912175126634
Energy: 1.2183013804043847
Energy: 1.2426655900927082
Energy: 1.2424528298893598
Energy: 1.2180432978276297
Energy: 1.2432036690786807
Energy: 1.2074762504334569
Energy: 1.206890452878864
Energy: 1.1520165628421328
Energy: 1.2037802299602098
Energy: 1.2066228584477363
Energy: 1.1551201526792647
Energy: 1.260320724975356
Energy: 1.1735340297829668
Energy: 1.2722631845716865
Energy: 1.264555344482441
Energy: 1.1738679597732373
Energy: 1.3431027943533986
Energy: 1.235721821669578
Energy: 1.1524529329690385
Energy: 1.2949374572793644
Energy: 1.1772101292462598
Energy: 1.152243041969079
Energy: 1.2472902637079186
Energy: 1.1791448326919225
Energy: 1.2046835347103122
Energy: 1.1519593512972812
Energy: 1.1789870402042544
Energy: 1.1555680031441058
Energy: 1.1571722832569669
Energy: 1.179110721698651
Energy: 1.380867931509028
Energy: 1.1736151853783783
Energy: 1.2098035411224357
Energy: 1.3080832126506154
Energy: 1.1737710998095252
Energy: 1.19418931556412
Energy: 1.1680860859408337
Energy: 1.179668225049202
Energy: 1.206630084870975
Energy: 1.1696627983539596
Energy: 1.2067709047575848
Energy: 1.2067321937751698
Energy: 1.2419915715288694
Energy: 1.1729702030027698
Energy: 1.2379243764055157
Energy: 1.2427372231117442
Energy: 1.2725191130501714
Energy: 1.2472028232556618
Energy: 1.2678178546126737
Energy: 1.174015231974809
Energy: 1.2068452060344235
Energy: 1.2700728641211205
Energy: 1.1736187561169467
Energy: 1.1675668946638482
Energy: 1.1637207124358548
Energy: 1.170734352857846
Energy: 1.170268576876142
Energy: 1.1661257605437774
Energy: 1.1706416991007458
Energy: 1.1711096482661019
Energy: 1.170436051925393
Energy: 1.1725818317976544
Energy: 1.2242599597923283
Energy: 1.1705690192840956
Energy: 1.1720635768220717
Energy: 1.1708066345244206
Energy: 1.3522558624593766
Energy: 1.2704438467740122
Energy: 1.3181625045952188
Energy: 1.3447346634315225
Energy: 1.3541677904724976
Energy: 1.2771900626698531
Energy: 1.2662176646066985
Energy: 1.1793106391334167
Energy: 1.1681094842932052
Energy: 1.2680123167620192
Energy: 1.179276577119281
Energy: 1.2085456641496317
Energy: 1.4285189105605711
Energy: 1.177075885299854
Energy: 1.1945069174431495
Energy: 1.4113929890026469
Energy: 1.1773904896310807
Energy: 1.2595464642802803

minimum gb energy = 1.1519593512972812 eV
minimum distance =  2.31294808837564 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.6653211402368358
Energy: 1.2530255753657837
Energy: 1.2525138405010257
Energy: 1.6671398361998768
Energy: 1.1811282924146693
Energy: 1.252573369663697
Energy: 1.0705760493056746
Energy: 1.203857699069404
Energy: 1.0957105886132787
Energy: 1.226481774611878
Energy: 1.2103218003994816
Energy: 1.0948242055372284
Energy: 1.2428614066967996
Energy: 1.133512192220075
Energy: 1.1404967930853223
Energy: 1.244166013616922
Energy: 1.088390193240472
Energy: 1.1407816890763602
Energy: 1.1430862494717589
Energy: 1.095526603622688
Energy: 1.0534100149724388
Energy: 1.1422575748166104
Energy: 1.3682449125054232
Energy: 1.0526227582756758
Energy: 1.093109078568197
Energy: 1.2013563878801083
Energy: 1.141556681579984
Energy: 1.0935032516015888
Energy: 1.2035234402726482
Energy: 1.1414456458333981
Energy: 1.323591916728371
Energy: 1.1796574478471158
Energy: 1.1803135363012742
Energy: 1.3298910106195996
Energy: 1.1828199759588125
Energy: 1.1809981521397084
Energy: 1.1808993224637645
Energy: 1.0305683417701497
Energy: 1.030903586285444
Energy: 1.1827168148037972
Energy: 1.0345179235089261
Energy: 1.180313484206227
Energy: 1.164423442457245
Energy: 1.0949574592032805
Energy: 1.0927898404582874
Energy: 1.1622661884282492
Energy: 1.0938724821725896
Energy: 1.059261268843607
Energy: 1.3840290507053392
Energy: 1.140824022352189
Energy: 1.2437904372947337
Energy: 1.3552326960215495
Energy: 1.1493130653978822
Energy: 1.1931525166621606
Energy: 1.3558021461441436
Energy: 1.179578130659971
Energy: 1.243686582283898
Energy: 1.0701490269419178
Energy: 1.183334046022734
Energy: 1.19255155681069
Energy: 1.1638897250751787
Energy: 1.0947598755209529
Energy: 1.0523467943061517
Energy: 1.1647393872487517
Energy: 1.206645997444675
Energy: 1.059160724825044
Energy: 1.142092163292731
Energy: 1.1337286175884405
Energy: 1.1338527095315734
Energy: 1.1416600824241614
Energy: 1.3134247846334108
Energy: 1.1413856516595557
Energy: 1.058206420819802
Energy: 1.0945235017386508
Energy: 1.0951270477163844
Energy: 1.05849654956157
Energy: 1.2040719284163552
Energy: 1.0932750557812598
Energy: 1.3310358097011374
Energy: 1.180478518084436
Energy: 1.1811153473902414
Energy: 1.3273246140505335
Energy: 1.1794847354564406
Energy: 1.181213692526845
Energy: 1.1803089721032356
Energy: 1.1013312778758952
Energy: 1.140751752558085
Energy: 1.181206175731309
Energy: 1.101145060124008
Energy: 1.1785863637218985
Energy: 1.241804603488754
Energy: 1.0306872964462597
Energy: 1.030976601888454
Energy: 1.2433850667623592
Energy: 1.0309022832603665
Energy: 1.1412554875725505
Energy: 1.0706730801309159
Energy: 1.095670770036085
Energy: 1.0957792969362832
Energy: 1.0711185283009441
Energy: 1.1476673126869588
Energy: 1.0952827766670372

minimum gb energy = 1.0305683417701497 eV
minimum distance =  2.26062340034685 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.4363237923891639
Energy: 1.1129870676787668
Energy: 1.3211844577095948
Energy: 1.1943935901204912
Energy: 1.1616465515949117
Energy: 1.3181217196965735
Energy: 1.2437711306004624
Energy: 1.1632540929610886
Energy: 1.1355946498915201
Energy: 1.2482912707879799
Energy: 1.1634933716315408
Energy: 1.1084749430044611
Energy: 1.2075004827673625
Energy: 1.2028345237139215
Energy: 1.216985890032358
Energy: 1.208164311208242
Energy: 1.373405850708272
Energy: 1.2420645721073584
Energy: 1.1806746376786355
Energy: 1.1116005546110364
Energy: 1.109807683812216
Energy: 1.1809430417694713
Energy: 1.1306487033342654
Energy: 1.1818898797781103
Energy: 1.232601736152371
Energy: 1.164845685184701
Energy: 1.1350195275761477
Energy: 1.2342113243960928
Energy: 1.1571339626301707
Energy: 1.1218004720684263
Energy: 1.1229354384577683
Energy: 1.1233891674302994
Energy: 1.1263791746736134
Energy: 1.123249718497896
Energy: 1.1930819733315678
Energy: 1.1251909180755157
Energy: 1.1598699565926243
Energy: 1.156774648233443
Energy: 1.2096380302436178
Energy: 1.1605372736598463
Energy: 1.4531809150443973
Energy: 1.187823919591187
Energy: 1.197777393953735
Energy: 1.0878420116073964
Energy: 1.1259279830205104
Energy: 1.1922334001490364
Energy: 1.138850497474037
Energy: 1.108997404341355
Energy: 1.3459356437167191
Energy: 1.154465060576066
Energy: 1.1543362823327215
Energy: 1.3478397809031373
Energy: 1.1564684682959765
Energy: 1.1753556016635411
Energy: 1.3616544196306217
Energy: 1.111968713228575
Energy: 1.1098146115112224
Energy: 1.2836790094693735
Energy: 1.111950290540327
Energy: 1.1101419479082633
Energy: 1.1787407977124997
Energy: 1.162853527238838
Energy: 1.1271964908770435
Energy: 1.1791744644439903
Energy: 1.2430598785742146
Energy: 1.1093095561694994
Energy: 1.1574377125286164
Energy: 1.227054174023018
Energy: 1.131763281688751
Energy: 1.1570251486263354
Energy: 1.2284377504228807
Energy: 1.1315942855954049
Energy: 1.4305971098470016
Energy: 1.1788801954700656
Energy: 1.1796669177670849
Energy: 1.3920149066961642
Energy: 1.1896436885757888
Energy: 1.1212353760733011
Energy: 1.2888641898791537
Energy: 1.2055035208396483
Energy: 1.224182789601408
Energy: 1.290118399742415
Energy: 1.2055414922025462
Energy: 1.1456492954349315
Energy: 1.166079537823869
Energy: 1.1243864802668393
Energy: 1.1053153011002532
Energy: 1.182284935801505
Energy: 1.1210630144680613
Energy: 1.1389912873463746
Energy: 1.1327141130786027
Energy: 1.2074382151916871
Energy: 1.2009861173602718
Energy: 1.1341405467649495
Energy: 1.1763596821345377
Energy: 1.251715470907806
Energy: 1.1322998298418763
Energy: 1.2192669822286226
Energy: 1.1103255957029996
Energy: 1.1324263804771406
Energy: 1.1873070635588643
Energy: 1.145415648309906
Energy: 1.3156633474386974
Energy: 1.2113631958252657
Energy: 1.2068922087207796
Energy: 1.3167873775447443
Energy: 1.2063968158442535
Energy: 1.2058247924735876
Energy: 1.2051180424098469
Energy: 1.2527907503698248
Energy: 1.2059500016006177
Energy: 1.2052482978953771
Energy: 1.2894437030708779
Energy: 1.2099886879641986
Energy: 1.206530494111029
Energy: 1.2112659998264528
Energy: 1.107753872430317
Energy: 1.206450393679897
Energy: 1.2074779762440042
Energy: 1.2368018008265191
Energy: 1.2441422764941223
Energy: 1.1420820099624225
Energy: 1.1346440151541364
Energy: 1.2176983009123155
Energy: 1.1369610033149142
Energy: 1.1360668655779038

minimum gb energy = 1.0878420116073964 eV
minimum distance =  2.30865552311222 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.2081824669673298
Energy: 1.0258027785210861
Energy: 1.0259526247065007
Energy: 1.2116375190582882
Energy: 1.6422533078921715
Energy: 1.025932226727213
Energy: 1.0243384291255104
Energy: 1.0464197250182115
Energy: 1.0452460360769469
Energy: 1.2535937697688853
Energy: 1.052099888350503
Energy: 1.0754008178762924
Energy: 1.13066758157393
Energy: 1.1254185461319617
Energy: 1.1263681985020013
Energy: 1.1315325695029828
Energy: 1.1983358148494543
Energy: 1.1325029247256297
Energy: 1.1246472769958402
Energy: 1.1470854216796
Energy: 1.0468168483226457
Energy: 1.0479354924812512
Energy: 1.0469635095998702
Energy: 1.0470647218279017
Energy: 1.2028618255885937
Energy: 1.0537017444826902
Energy: 1.0548047053575857
Energy: 1.2046966231150131
Energy: 1.052905644041911
Energy: 1.0461860034903137
Energy: 1.1242503487024236
Energy: 1.253277969333753
Energy: 1.0762497027624678
Energy: 1.1260005311171573
Energy: 1.2515025832548952
Energy: 1.0757993208923808
Energy: 1.0475647528456324
Energy: 1.1971604110609206
Energy: 1.0258839567266969
Energy: 1.049367081917085
Energy: 1.2116326525038674
Energy: 1.026665917190596
Energy: 1.051596080517451
Energy: 1.0246930056802335
Energy: 1.0739729766980337
Energy: 1.0526558546010996
Energy: 1.0248842965702532
Energy: 1.046798746781239
Energy: 1.0544760015250163
Energy: 1.1319010032682864
Energy: 1.132693181246043
Energy: 1.1270100374667438
Energy: 1.1305868446078036
Energy: 1.126469711970617
Energy: 1.054935590963562
Energy: 1.1243300409779495
Energy: 1.1255765998752545
Energy: 1.05261257120214
Energy: 1.1239615302104582
Energy: 1.1252119594189518
Energy: 1.0517343331049076
Energy: 1.1521918795194777
Energy: 1.0752234006409405
Energy: 1.0522278228411834
Energy: 1.2055975061373403
Energy: 1.0466074031948436
Energy: 1.2553580196173981
Energy: 1.124010666327243
Energy: 1.076553423048321
Energy: 1.2559910874174935
Energy: 1.1232460051352648
Energy: 1.0753415447858627
Energy: 1.1964186762760118
Energy: 1.0438523311408001
Energy: 1.027166302580349
Energy: 1.200000386874843
Energy: 1.0475412892846516
Energy: 1.026052726849351
Energy: 1.1418517456898571
Energy: 1.0534336168931195
Energy: 1.0562235360263985
Energy: 1.1415501768141574
Energy: 1.052148567900893
Energy: 1.027882032105655
Energy: 1.130606047087535
Energy: 1.1240131285680404
Energy: 1.1242758954335312
Energy: 1.1309520343916653
Energy: 1.1973271987163436
Energy: 1.125255332554539
Energy: 1.1240437971356287
Energy: 1.126117957566521
Energy: 1.1258689493558274
Energy: 1.1251714371589863
Energy: 1.2304348527956264
Energy: 1.1258008014584724
Energy: 1.1185591108690647
Energy: 1.0539607565243767
Energy: 1.046366058803349
Energy: 1.1182473443913352
Energy: 1.0526240220178609
Energy: 1.0751514797362887
Energy: 1.1233761308219712
Energy: 1.0550133161934103
Energy: 1.0464607148388327
Energy: 1.1236695789155058
Energy: 1.0527914472192133
Energy: 1.0479744744611788
Energy: 1.0430285991304389
Energy: 1.1963654286410315
Energy: 1.1384846580573926
Energy: 1.0457148856907983
Energy: 1.199677931295548
Energy: 1.0282632888088303
Energy: 1.0541407498380677
Energy: 1.1966076267857262
Energy: 1.1387342545765313
Energy: 1.0562061437254324
Energy: 1.1996025663969956
Energy: 1.028294825573924
Energy: 1.054558774975478
Energy: 1.054517742807602
Energy: 1.04649640777701
Energy: 1.055079843976316
Energy: 1.0539603509512563
Energy: 1.0472233242454383
Energy: 1.1079916284168596
Energy: 1.1249804264065946
Energy: 1.1257397890817291
Energy: 1.108194282968786
Energy: 1.1265176989539771
Energy: 1.1263584180415027
Energy: 1.0519400618008716
Energy: 1.0767596705364542
Energy: 1.0757838274458846
Energy: 1.0520682099677214
Energy: 1.1243647575158853
Energy: 1.0757673699962298
Energy: 1.0518644526470893
Energy: 1.1450240772452436
Energy: 1.0467895861567629
Energy: 1.0525247056981546
Energy: 1.227692036510975
Energy: 1.0459803461351522
Energy: 1.1413070772945049
Energy: 1.0440581910676152
Energy: 1.0460234896573088
Energy: 1.141331510945468
Energy: 1.0436920379190735
Energy: 1.0284403521612213

minimum gb energy = 1.0243384291255104 eV
minimum distance =  2.35484234205069 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.9722079004011568
Energy: 1.244851835622087
Energy: 1.864434253485272
Energy: 1.6045576316271357
Energy: 1.2852921412950247
Energy: 1.8649318013579628
Energy: 1.1162563829682688
Energy: 1.1499290715446207
Energy: 1.1604371571299517
Energy: 1.1809928514566155
Energy: 1.1482295200795396
Energy: 1.1600517832937622
Energy: 1.1492329044309926
Energy: 1.2743308242807052
Energy: 1.1344086911596225
Energy: 1.149651467227068
Energy: 1.2765094226464846
Energy: 1.1273495712948134
Energy: 1.1478342197300977
Energy: 1.1245407465596915
Energy: 1.1250308814578003
Energy: 1.1481869250003083
Energy: 1.1490367916647728
Energy: 1.1266047762813602
Energy: 1.307681126710973
Energy: 1.1492745964434463
Energy: 1.1492753743217334
Energy: 1.3093084812863327
Energy: 1.1490052389152068
Energy: 1.1270825204074386
Energy: 1.1485384816153361
Energy: 1.1290437038305499
Energy: 1.2225149786846887
Energy: 1.148457638644833
Energy: 1.157000316204498
Energy: 1.1240388137274147
Energy: 1.3191128125006197
Energy: 1.2633347995781075
Energy: 1.1625180514337854
Energy: 1.358407801616254
Energy: 1.2115879099692608
Energy: 1.1739912747776458
Energy: 1.1633589104210422
Energy: 1.237102891828783
Energy: 1.190084117547138
Energy: 1.1626629304195428
Energy: 1.1124228173918962
Energy: 1.1818423155750872
Energy: 1.2601126299450323
Energy: 1.1504392781690935
Energy: 1.127406455647155
Energy: 1.2621652563639074
Energy: 1.1498862235952174
Energy: 1.1374058881759594
Energy: 1.1091927232111753
Energy: 1.1414209741319705
Energy: 1.1148327563270164
Energy: 1.109315101960182
Energy: 1.1533359820679312
Energy: 1.1155497693814256
Energy: 1.2516995559609594
Energy: 1.2398760783797755
Energy: 1.1130738709129748
Energy: 1.2525416896603587
Energy: 1.2389754016031145
Energy: 1.1121119809128066
Energy: 1.1160726645201269
Energy: 1.1141297337663747
Energy: 1.1159884634077022
Energy: 1.1160395326564447
Energy: 1.1528145945758657
Energy: 1.110007078214332
Energy: 1.2187647409620923
Energy: 1.2408251937379344
Energy: 1.125603988434072
Energy: 1.2446018627131306
Energy: 1.2682973047128694
Energy: 1.1477396344081197
Energy: 1.1612235263742767
Energy: 1.1628265955178547
Energy: 1.1629488606102765
Energy: 1.1612007195565952
Energy: 1.2201286216751706
Energy: 1.1629307242401707
Energy: 1.1160408274870262
Energy: 1.237894271496158
Energy: 1.2278876907543885
Energy: 1.1160315488718868
Energy: 1.237556421919668
Energy: 1.1275613221367446
Energy: 1.1161326834340946
Energy: 1.1442355107341724
Energy: 1.2617904802180948
Energy: 1.1156575478780226
Energy: 1.2370004592939197
Energy: 1.099605065455059
Energy: 1.26170200450949
Energy: 1.1582328619930184
Energy: 1.1294669439124396
Energy: 1.260284964365703
Energy: 1.1577261744646
Energy: 1.1296129014142189
Energy: 1.1628868466659699
Energy: 1.2226604914801509
Energy: 1.1122260090015021
Energy: 1.1628423688006464
Energy: 1.2226606845111967
Energy: 1.1650198355504549
Energy: 1.1681494085723412
Energy: 1.3080782699248787
Energy: 1.104325222190636
Energy: 1.1698277956427656
Energy: 1.3035198221008086
Energy: 1.1615701990295977
Energy: 1.1454702008018494
Energy: 1.2284285341240861
Energy: 1.1143442004937973
Energy: 1.146451202343677
Energy: 1.2534994933672234
Energy: 1.1421392523157936
Energy: 1.2395164838852932
Energy: 1.1163872679288775
Energy: 1.1254298441576016
Energy: 1.2398997186906071
Energy: 1.1160135109983693
Energy: 1.0985298296655612
Energy: 1.2380449969809588
Energy: 1.1177073899614391
Energy: 1.1291800309531939
Energy: 1.2372843706551317
Energy: 1.1163399644899397
Energy: 1.1101944897188807
Energy: 1.2043219842116744
Energy: 1.2537324936739729
Energy: 1.1210592523964864
Energy: 1.205078311969107
Energy: 1.2545210721789744
Energy: 1.185505413424116
Energy: 1.2372021823441144
Energy: 1.0948047509706007
Energy: 1.185836980716313
Energy: 1.2384031237638213
Energy: 1.0935453855081982
Energy: 1.1988990190403428
Energy: 1.2950391661443261
Energy: 1.1750362595576662
Energy: 1.175894414379185
Energy: 1.2887995950530335
Energy: 1.1744637312267634
Energy: 1.1093255649508411
Energy: 1.2805565529989147
Energy: 1.1267490345775053
Energy: 1.1261604612937033
Energy: 1.283565998246392
Energy: 1.1256762123976554
Energy: 1.1260012028207986
Energy: 1.1521627712205011
Energy: 1.3036886077821086
Energy: 1.1153337828258807
Energy: 1.1525668246992857
Energy: 1.2825054959286686
Energy: 1.1165475122801607
Energy: 1.1489187045581284
Energy: 1.246040172884342
Energy: 1.2105377210085733
Energy: 1.149264891630345
Energy: 1.2744579294699276
Energy: 1.1334256514081382
Energy: 1.2153439049401837
Energy: 1.2552762364166428
Energy: 1.2548639319654924
Energy: 1.2158731020274887
Energy: 1.2550144289696972
Energy: 1.1812408780559225

minimum gb energy = 1.0935453855081982 eV
minimum distance =  2.28876122441026 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.8252968066573083
Energy: 1.970357284304102
Energy: 1.970077427713484
Energy: 1.8285001436770223
Energy: 2.2424086413908615
Energy: 1.509377819087514
Energy: 1.1785852119624165
Energy: 1.1195051949794546
Energy: 1.1305784313717566
Energy: 1.1297869660188073
Energy: 1.1217579123995172
Energy: 1.1308310887607878
Energy: 1.1297447016579325
Energy: 1.2796918629457368
Energy: 1.2022856413097733
Energy: 1.1311480953577426
Energy: 1.2296074977204696
Energy: 1.0940482676181695
Energy: 1.117725710514235
Energy: 1.0876715780305772
Energy: 1.0877463526782214
Energy: 1.1192679701914157
Energy: 1.1184703711429833
Energy: 1.0888539238767647
Energy: 1.2682221425743512
Energy: 1.1287602505961243
Energy: 1.128206191274629
Energy: 1.2674111175540526
Energy: 1.1337407957484742
Energy: 1.1019169821444779
Energy: 1.1876196789063427
Energy: 1.084568142127929
Energy: 1.1732235191034546
Energy: 1.1896682259866214
Energy: 1.1314645640820404
Energy: 1.1795408735657882
Energy: 1.100011110979562
Energy: 1.0945228871317192
Energy: 1.168943304207188
Energy: 1.1003896919127076
Energy: 1.155796423789479
Energy: 1.1608008863643458
Energy: 1.1745757159833006
Energy: 1.179789448753345
Energy: 1.175094089923527
Energy: 1.175550593251046
Energy: 1.1691402780619224
Energy: 1.1743938273778063
Energy: 1.226054263593384
Energy: 1.1303260253685237
Energy: 1.1314867295296394
Energy: 1.2282078881765413
Energy: 1.1292811072741504
Energy: 1.1694315344340902
Energy: 1.229846634159153
Energy: 1.088084324063257
Energy: 1.0918802239471948
Energy: 1.1646852323909485
Energy: 1.1342785437966563
Energy: 1.1412589333146919
Energy: 1.306072637615334
Energy: 1.163171430377888
Energy: 1.3044212894849205
Energy: 1.3079070365530603
Energy: 1.1875278534013747
Energy: 1.076774802884201
Energy: 1.1399121458617363
Energy: 1.0877287831383893
Energy: 1.1405514150242582
Energy: 1.1401690465729755
Energy: 1.1400399996763704
Energy: 1.090941252352989
Energy: 1.2370048826855962
Energy: 1.099080484287746
Energy: 1.0976692150579652
Energy: 1.21729465549839
Energy: 1.0993708111521792
Energy: 1.0979921623042959
Energy: 1.1077415552360315
Energy: 1.138582051046389
Energy: 1.1386545603552216
Energy: 1.107828800244691
Energy: 1.1410290814501516
Energy: 1.1395020756787264
Energy: 1.1281627743100735
Energy: 1.2347731445981494
Energy: 1.176188224298988
Energy: 1.130108035503527
Energy: 1.238138931082345
Energy: 1.107430509634464
Energy: 1.1306364036072614
Energy: 1.1670952108359334
Energy: 1.1467795323620427
Energy: 1.130361367927393
Energy: 1.168167341004109
Energy: 1.0887352222229987
Energy: 1.2338210989552028
Energy: 1.2540278639867128
Energy: 1.099352082286452
Energy: 1.2353610743133252
Energy: 1.2544194043223174
Energy: 1.0747410665486705
Energy: 1.1790757790464388
Energy: 1.1401378586746935
Energy: 1.129748446827811
Energy: 1.1787947777172487
Energy: 1.13971913985624
Energy: 1.1705714968054985
Energy: 1.1284302669161594
Energy: 1.3022762217345667
Energy: 1.087837961865009
Energy: 1.1288715055658989
Energy: 1.2264048694551606
Energy: 1.1098404141870206
Energy: 1.1256616321449584
Energy: 1.1381119054034985
Energy: 1.0896108463970657
Energy: 1.127370813675714
Energy: 1.1653984030169742
Energy: 1.0889653626106632
Energy: 1.2568751053524367
Energy: 1.1278265583952702
Energy: 1.0869969278098732
Energy: 1.2589631897565607
Energy: 1.1318801713104099
Energy: 1.0853428643963607
Energy: 1.2224205636508476
Energy: 1.1317520938591707
Energy: 1.087159656316623
Energy: 1.2229425016646371
Energy: 1.130958134899284
Energy: 1.1353976710565723
Energy: 1.2431075550271078
Energy: 1.0817277058013481
Energy: 1.08105855511978
Energy: 1.237031395600884
Energy: 1.1572899637665242
Energy: 1.0790257381060606
Energy: 1.1743595286563395
Energy: 1.1208978336212394
Energy: 1.1240848584054421
Energy: 1.1792092151654876
Energy: 1.1060778200685644
Energy: 1.1772195320426777
Energy: 1.2042985564484887
Energy: 1.130509999814749
Energy: 1.120204577759231
Energy: 1.206520027863661
Energy: 1.1288278185357787
Energy: 1.0867573066479195
Energy: 1.23264490402251
Energy: 1.1339286512136328
Energy: 1.0918402506117124
Energy: 1.2284903220516383
Energy: 1.1406071813131118
Energy: 1.0920087920634374
Energy: 1.0886111293253096
Energy: 1.0798402247925762
Energy: 1.078716074209932
Energy: 1.0891955899049652
Energy: 1.1879780180064683
Energy: 1.0913506435820124
Energy: 1.135627599312346
Energy: 1.2668828198065345
Energy: 1.080607592268295
Energy: 1.1366365844111426
Energy: 1.1643550023345393
Energy: 1.1083746274962243
Energy: 1.1898425859927144
Energy: 1.1643002418559136
Energy: 1.163869175456301
Energy: 1.190549215342342
Energy: 1.1856221067604749
Energy: 1.1396294403867655
Energy: 1.2279885403300472
Energy: 1.1395504176074027
Energy: 1.1398618495343686
Energy: 1.2296442501953861
Energy: 1.139243287786852
Energy: 1.1403905091489688
Energy: 1.1388773520660158
Energy: 1.2560328746555791
Energy: 1.1555777807885013
Energy: 1.1397992256002998
Energy: 1.232088322198008
Energy: 1.108663914476003
Energy: 1.1282169735585985
Energy: 1.1416670810356668
Energy: 1.171390772536874
Energy: 1.1286560555701433
Energy: 1.230027854883624
Energy: 1.1069165689316944
Energy: 1.1517510907930455
Energy: 1.226716237643097
Energy: 1.1785769422997883
Energy: 1.1531015961023696
Energy: 1.2263933190004237
Energy: 1.174251370461963

minimum gb energy = 1.0747410665486705 eV
minimum distance =  2.28993290411697 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.02047235925606084
Energy: 0.02147068574695549
Energy: 0.021911749496314033
Energy: 0.023183373595870502
Energy: 1.1002639475768925
Energy: 0.021057022188730033
Energy: 0.02112664204652914
Energy: 0.1871838400486467
Energy: 0.18652042196078994
Energy: 0.18554867851725418
Energy: 0.18510342278978278
Energy: 0.18580740915988245
Energy: 1.3757943770385779
Energy: 1.1020461858332307
Energy: 1.1040159055677865
Energy: 1.1017969074848697
Energy: 1.1000882025565841
Energy: 1.1027704857478657
Energy: 0.443702849454751
Energy: 0.18718384004952812
Energy: 0.18652042195938998
Energy: 0.1855486785154394
Energy: 0.18510342279159755
Energy: 0.18580740916029723

minimum gb energy = 0.02047235925606084 eV
minimum distance =  2.46252343343781 Angstroms
sigma value = 1